SCHEMBL7776464

SCHEMBL7776464

CC(=O)O[C@H]1CC[C@H]2[C@@H]3CCC4=CC(=O)C(C)C[C@@H]4[C@H]3CC[C@]12C

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 3/20 0.52
▸ LMNA P02545 2/20 0.52
▸ SERPINA6 P08185 2/20 0.50
▸ CYP3A4 P08684 2/20 0.49
▸ MEN1 O00255 1/20 0.49
▸ ALOX15 P16050 1/20 0.49
▸ MAPK1 P28482 1/20 0.49
▸ BRCA1 P38398 1/20 0.49
▸ RECQL P46063 1/20 0.49
▸ KMT2A Q03164 1/20 0.49
▸ ALDH1A1 P00352 2/20 0.47
▸ SLC22A1 O15245 1/20 0.47
▸ SHBG P04278 1/20 0.47
▸ THRB P10828 1/20 0.47
▸ ESR1 P03372 3/20 0.47
▸ MCL1 Q07820 1/20 0.47
▸ CYP1A2 P05177 1/20 0.47
▸ HIF1A Q16665 1/20 0.47
▸ HSD17B10 Q99714 1/20 0.47
▸ TP53 P04637 1/20 0.47

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL5550789 0.90 MAPT (0.53) MAPTLMNASERPINA6CYP3A4MEN1
SCHEMBL11517687 0.86 MAPT (0.49) MAPTLMNASERPINA6CYP3A4MEN1
SCHEMBL13804528 0.84 MAPT (0.71) MAPTLMNASERPINA6CYP3A4MEN1
SCHEMBL17302789 0.84 MAPT (0.71) MAPTLMNASERPINA6CYP3A4MEN1
SCHEMBL2930366 0.84 MAPT (0.71) MAPTLMNASERPINA6CYP3A4MEN1
SCHEMBL13177160 0.84 MAPT (0.71) MAPTLMNASERPINA6CYP3A4MEN1
SCHEMBL16741272 0.84 SERPINA6 (0.71) MAPTLMNASERPINA6CYP3A4MEN1
SCHEMBL5551986 0.83 MAPT (0.59) MAPTLMNASERPINA6CYP3A4MEN1
SCHEMBL16188590 0.82 SHBG (0.69) MAPTLMNASERPINA6CYP3A4MAPK1
SCHEMBL7615553 0.82 SHBG (0.69) MAPTLMNASERPINA6CYP3A4MAPK1

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 29 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11912737-B2 19-nor neuroactive steroids and methods of use thereof Sage Therpeutics, Inc. (US) 2024-02-27 — — US disclosed
US-11912737-B2 19-nor neuroactive steroids and methods of use thereof Sage Therpeutics, Inc. (US) 2024-02-27 — — US disclosed
US-11241446-B2 19-nor C3, 3-disubstituted C21-N-pyrazolyl steroids and methods of use thereof SAGE THERAPEUTICS, INC. (US) 2022-02-08 — — US disclosed
US-20210139531-A1 19-NOR NEUROACTIVE STEROIDS AND METHODS OF USE THEREOF SAGE THERAPEUTICS, INC. 2021-05-13 — — US disclosed
US-20210061849-A1 NEUROACTIVE STEROIDS, COMPOSITIONS, AND USES THEREOF SAGE THERAPEUTICS, INC. 2021-03-04 — — US disclosed
US-10822370-B2 19-nor neuroactive steroids and methods of use thereof SAGE THERAPEUTICS, INC. (US) 2020-11-03 — — US disclosed
US-20200165291-A1 NEUROACTIVE STEROIDS, COMPOSITIONS, AND USES THEREOF SAGE THERAPEUTICS, INC. 2020-05-28 — — US disclosed
US-20200155576-A1 19-NOR C3, 3-DISUBSTITUTED C21-N-PYRAZOLYL STEROIDS AND METHODS OF USE THEREOF SAGE THERAPEUTICS, INC. 2020-05-21 — — US disclosed
US-10342810-B2 19-nor C3, 3-disubstituted C21-N-pyrazolyl steroids and methods of use thereof SAGE THERAPEUTICS, INC. (US) 2019-07-09 — — US disclosed
US-20190112331-A1 19-NOR NEUROACTIVE STEROIDS AND METHODS OF USE THEREOF SAGE THERAPEUTICS, INC. 2019-04-18 — — US disclosed
US-9512165-B2 19-nor C3, 3-disubstituted C21-N-pyrazolyl steroids and methods of use thereof SAGE THERAPEUTICS, INC. (US) 2016-12-06 — — US disclosed
US-9512165-B2 19-nor C3, 3-disubstituted C21-N-pyrazolyl steroids and methods of use thereof SAGE THERAPEUTICS, INC. (US) 2016-12-06 — — US disclosed
US-20160108080-A1 19-NOR C3, 3-DISUBSTITUTED C21-N-PYRAZOLYL STEROIDS AND METHODS OF USE THEREOF SAGE THERAPEUTICS, INC. (US) 2016-04-21 — — US disclosed
US-20160108080-A1 19-NOR C3, 3-DISUBSTITUTED C21-N-PYRAZOLYL STEROIDS AND METHODS OF USE THEREOF SAGE THERAPEUTICS, INC. (US) 2016-04-21 — — US disclosed
US-20160068563-A1 19-NOR NEUROACTIVE STEROIDS AND METHODS OF USE THEREOF SAGE THERAPEUTICS, INC. 2016-03-10 — — US disclosed
US-20160068563-A1 19-NOR NEUROACTIVE STEROIDS AND METHODS OF USE THEREOF SAGE THERAPEUTICS, INC. 2016-03-10 — — US disclosed
WO-2015180679-A1 NEUROACTIVE STEROIDS, COMPOSITIONS, AND USES THEREOF SAGE THERAPEUTICS, INC. (US) 2015-12-03 — — WO disclosed
WO-2014169836-A1 19-NOR NEUROACTIVE STEROIDS AND METHODS OF USE THEREOF SAGE THERAPEUTICS, INC. (US) 2014-10-23 — — WO disclosed
EP-1128810-A1 DRUG DELIVERY DEVICE, ESPECIALLY FOR THE DELIVERY OF ANDROGENS LEIRAS OY (FI) 2001-09-05 — — EP disclosed
WO-2000028967-A1 DRUG DELIVERY DEVICE, ESPECIALLY FOR THE DELIVERY OF ANDROGENS LEIRAS OY (FI) 2000-05-25 — — WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (11 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20190112331-A1 19-NOR NEUROACTIVE STEROIDS AND METHODS OF USE THEREOF NR3C2, HSD3B1, HSD3B2 MAPT 1029/4885LMNA 2913/4885SERPINA6 407/4885
US-20160108080-A1 19-NOR C3, 3-DISUBSTITUTED C21-N-PYRAZOLYL STEROIDS AND METHODS OF USE THEREOF NR3C2, CYP11B1, NR3C1 MAPT 1908/4885LMNA 2718/4885SERPINA6 931/4885
US-20200165291-A1 NEUROACTIVE STEROIDS, COMPOSITIONS, AND USES THEREOF CNR1, NR3C2, CNR2 MAPT 1381/4885LMNA 3434/4885SERPINA6 560/4885
US-11912737-B2 19-nor neuroactive steroids and methods of use thereof NR3C2, HSD3B1, HSD3B2 MAPT 1029/4885LMNA 2913/4885SERPINA6 407/4885
US-20200155576-A1 19-NOR C3, 3-DISUBSTITUTED C21-N-PYRAZOLYL STEROIDS AND METHODS OF USE THEREOF NR3C2, NR3C1, CYP11B1 MAPT 1772/4885LMNA 2657/4885SERPINA6 1023/4885
US-10342810-B2 19-nor C3, 3-disubstituted C21-N-pyrazolyl steroids and methods of use thereof NR3C2, NR3C1, CYP11B1 MAPT 1772/4885LMNA 2657/4885SERPINA6 1023/4885
US-11241446-B2 19-nor C3, 3-disubstituted C21-N-pyrazolyl steroids and methods of use thereof NR3C2, NR3C1, CYP11B1 MAPT 1772/4885LMNA 2657/4885SERPINA6 1023/4885
US-20210139531-A1 19-NOR NEUROACTIVE STEROIDS AND METHODS OF USE THEREOF NR3C2, HSD3B1, HSD3B2 MAPT 1029/4885LMNA 2913/4885SERPINA6 407/4885
US-20160068563-A1 19-NOR NEUROACTIVE STEROIDS AND METHODS OF USE THEREOF NR3C2, HSD3B1, HSD3B2 MAPT 1029/4885LMNA 2913/4885SERPINA6 407/4885
US-10822370-B2 19-nor neuroactive steroids and methods of use thereof NR3C2, HSD3B1, HSD3B2 MAPT 1029/4885LMNA 2913/4885SERPINA6 407/4885
US-20210061849-A1 NEUROACTIVE STEROIDS, COMPOSITIONS, AND USES THEREOF CNR1, NR3C2, CNR2 MAPT 1381/4885LMNA 3434/4885SERPINA6 560/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.

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