SCHEMBL17254987

SCHEMBL17254987

CNC(=O)c1cc2ccc(NCCN(C)C)nc2n2c1nc1ccccc12

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 8/20 0.41
▸ HSP90AA1 P07900 2/20 0.41
▸ MAPK1 P28482 1/20 0.41
▸ MCL1 Q07820 1/20 0.41
▸ KMT2A Q03164 5/20 0.41
▸ MEN1 O00255 4/20 0.41
▸ ALDH1A1 P00352 3/20 0.41
▸ CASP1 P29466 3/20 0.41
▸ CASP7 P55210 3/20 0.41
▸ POLB P06746 2/20 0.41
▸ TSHR P16473 2/20 0.41
▸ RXFP1 Q9HBX9 1/20 0.39
▸ GAA P10253 2/20 0.39
▸ LMNA P02545 2/20 0.39
▸ HTT P42858 1/20 0.39
▸ POLR1A O95602 2/20 0.39
▸ PIM1 P11309 1/20 0.39
▸ MAPT P10636 2/20 0.38
▸ ATM Q13315 1/20 0.37
▸ ECE1 P42892 1/20 0.37

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
SCHEMBL17255077 0.92 KDM4E (0.46) KDM4EHSP90AA1MAPK1MCL1KMT2A
SCHEMBL18205761 0.90 KDM4E (0.42) KDM4EHSP90AA1MAPK1MCL1KMT2A
SCHEMBL18213594 0.87 KDM4E (0.40) KDM4EHSP90AA1MAPK1MCL1KMT2A
SCHEMBL17254977 0.86 KDM4E (0.47) KDM4EHSP90AA1MAPK1MCL1KMT2A
SCHEMBL18057385 0.85 MKNK1 (0.42) KDM4EHSP90AA1MAPK1MCL1KMT2A
SCHEMBL17254975 0.82 ALDH1A1 (0.49) KDM4EKMT2AMEN1ALDH1A1CASP1
SCHEMBL20057362 0.80 KDM4E (0.41) KDM4EHSP90AA1MAPK1MCL1KMT2A
SCHEMBL18057397 0.80 KDM4E (0.42) KDM4EHSP90AA1MAPK1MCL1KMT2A
SCHEMBL17255009 0.79 KDM4E (0.54) KDM4EHSP90AA1MAPK1MCL1KMT2A
SCHEMBL23919696 0.79 RAD52 (0.52) KDM4EALDH1A1HTTPOLR1AECE1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3219716-B1 NOVEL COMPOSITIONS, USES AND METHODS FOR MAKING THEM PIMERA INC (US) 2024-12-25 — — EP disclosed
US-11623928-B2 Compositions, uses and methods for making them Pimera, Inc. (US) 2023-04-11 — — US disclosed
US-11618752-B2 Compositions, uses and methods for making them Pimera, Inc. (US) 2023-04-04 — — US disclosed
US-20210094952-A1 NOVEL COMPOSITIONS, USES AND METHODS FOR MAKING THEM UNITED STATES GOVERNMENT 2021-04-01 — — US disclosed
US-20210094952-A1 NOVEL COMPOSITIONS, USES AND METHODS FOR MAKING THEM UNITED STATES GOVERNMENT 2021-04-01 — — US disclosed
US-20200361937-A1 NOVEL COMPOSITIONS, USES AND METHODS FOR MAKING THEM UNITED STATES GOVERNMENT 2020-11-19 — — US disclosed
US-20200361937-A1 NOVEL COMPOSITIONS, USES AND METHODS FOR MAKING THEM UNITED STATES GOVERNMENT 2020-11-19 — — US disclosed
US-10745403-B2 Compositions, uses and methods for making them Pimera, Inc. (US) 2020-08-18 — — US disclosed
US-10745403-B2 Compositions, uses and methods for making them Pimera, Inc. (US) 2020-08-18 — — US disclosed
US-10590134-B2 Compositions, uses and methods for making them Pimera, Inc. (US) 2020-03-17 — — US disclosed
US-9512123-B2 Compositions, uses and methods for making them Pimera, Inc. (US) 2016-12-06 — — US disclosed
US-9512123-B2 Compositions, uses and methods for making them Pimera, Inc. (US) 2016-12-06 — — US disclosed
US-9512123-B2 Compositions, uses and methods for making them Pimera, Inc. (US) 2016-12-06 — — US disclosed
US-20160326176-A1 Novel Compositions, Uses and Methods for Making Them PIMERA, INC 2016-11-10 — — US disclosed
US-20160326176-A1 Novel Compositions, Uses and Methods for Making Them PIMERA, INC 2016-11-10 — — US disclosed
US-20160326176-A1 Novel Compositions, Uses and Methods for Making Them PIMERA, INC 2016-11-10 — — US disclosed
US-20160257678-A1 NOVEL COMPOSITIONS, USES AND METHODS FOR MAKING THEM UNITED STATES GOVERNMENT 2016-09-08 — — US disclosed
US-20160257678-A1 NOVEL COMPOSITIONS, USES AND METHODS FOR MAKING THEM UNITED STATES GOVERNMENT 2016-09-08 — — US disclosed
US-20160257678-A1 NOVEL COMPOSITIONS, USES AND METHODS FOR MAKING THEM UNITED STATES GOVERNMENT 2016-09-08 — — US disclosed
WO-2015172123-A1 NOVEL COMPOSITIONS, USES AND METHODS FOR MAKING THEM HADDACH MUSTAPHA (US) 2015-11-12 — — 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 (8 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-11618752-B2 Compositions, uses and methods for making them BAX, CASP3, BCL2 KDM4E 2323/4885HSP90AA1 2036/4885MAPK1 1927/4885
US-20160326176-A1 Novel Compositions, Uses and Methods for Making Them BAX, CASP3, BCL2 KDM4E 2839/4885HSP90AA1 1645/4885MAPK1 2015/4885
US-10590134-B2 Compositions, uses and methods for making them BAX, CASP3, BCL2 KDM4E 2323/4885HSP90AA1 2036/4885MAPK1 1927/4885
US-10745403-B2 Compositions, uses and methods for making them BAX, CASP3, BCL2 KDM4E 2323/4885HSP90AA1 2036/4885MAPK1 1927/4885
US-20200361937-A1 NOVEL COMPOSITIONS, USES AND METHODS FOR MAKING THEM BAX, CASP3, BCL2 KDM4E 2839/4885HSP90AA1 1645/4885MAPK1 2015/4885
US-20160257678-A1 NOVEL COMPOSITIONS, USES AND METHODS FOR MAKING THEM BAX, CASP3, BCL2 KDM4E 2839/4885HSP90AA1 1645/4885MAPK1 2015/4885
US-20210094952-A1 NOVEL COMPOSITIONS, USES AND METHODS FOR MAKING THEM BAX, CASP3, BCL2 KDM4E 2839/4885HSP90AA1 1645/4885MAPK1 2015/4885
US-11623928-B2 Compositions, uses and methods for making them BAX, CASP3, BCL2 KDM4E 2323/4885HSP90AA1 2036/4885MAPK1 1927/4885

“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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