SCHEMBL1911488

SCHEMBL1911488

CC(C)N1CCN(CC(=O)N2CCOCC2)CC1

nearest known ligand 0.62

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ALOX15 P16050 1/20 0.62
TSHR P16473 1/20 0.62
HSD17B10 Q99714 1/20 0.62
KDM4E B2RXH2 3/20 0.57
LMNA P02545 1/20 0.53
RAB9A P51151 1/20 0.53
NPC1 O15118 1/20 0.49
HRH3 Q9Y5N1 7/20 0.47
ALDH1A1 P00352 2/20 0.47
POLB P06746 2/20 0.45
GAA P10253 1/20 0.45
SMN1; SMN2 Q16637 1/20 0.45
TDP1 Q9NUW8 1/20 0.45
L3MBTL1 Q9Y468 2/20 0.44

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
SCHEMBL13043899 0.93 HSD17B10 (0.73) ALOX15TSHRHSD17B10KDM4ELMNA
SCHEMBL13004984 0.88 GAA (0.55) ALOX15TSHRHSD17B10KDM4ELMNA
SCHEMBL13058951 0.84 GAA (0.57) ALOX15TSHRHSD17B10KDM4EHRH3
SCHEMBL13005052 0.83 KDM4E (0.61) ALOX15TSHRHSD17B10KDM4ELMNA
SCHEMBL1911518 0.82 ALOX15 (0.66) ALOX15TSHRHSD17B10KDM4ELMNA
SCHEMBL26981196 0.82 HSD17B10 (0.91) ALOX15TSHRHSD17B10KDM4ELMNA
SCHEMBL18289220 0.81 GAA (0.48) ALOX15TSHRHSD17B10KDM4ELMNA
SCHEMBL18704941 0.81 GAA (0.48) ALOX15TSHRHSD17B10KDM4EHRH3
SCHEMBL3767691 0.81 GAA (0.48) ALOX15TSHRHSD17B10KDM4ERAB9A
SCHEMBL9644662 0.81 TSHR (0.51) ALOX15TSHRHSD17B10KDM4ELMNA

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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11795170-B2 Therapeutic compounds, compositions and methods of use thereof GENENTECH, INC. (US) 2023-10-24 US disclosed
US-11795170-B2 Therapeutic compounds, compositions and methods of use thereof GENENTECH, INC. (US) 2023-10-24 US disclosed
US-11649241-B2 Pyrazolochlorophenyl compounds, compositions and methods of use thereof GENENTECH, INC. (US) 2023-05-16 US disclosed
US-20210009599-A1 THERAPEUTIC COMPOUNDS, COMPOSITIONS AND METHODS OF USE THEREOF GENENTECH, INC. (US) 2021-01-14 US disclosed
US-8097617-B2 Organic compounds NOVARTIS AG (CH) 2012-01-17 US disclosed
US-20090253689-A1 Organic Compounds NOVARTIS AG (CH) 2009-10-08 US 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 (4 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-11795170-B2 Therapeutic compounds, compositions and methods of use thereof JAK2, JAK1, JAK3 ALOX15 557/4885TSHR 4221/4885HSD17B10 1929/4885
US-20090253689-A1 Organic Compounds OAT, GPR119, OTC ALOX15 326/4885TSHR 2009/4885HSD17B10 213/4885
US-11649241-B2 Pyrazolochlorophenyl compounds, compositions and methods of use thereof JAK1, JAK2, JAK3 ALOX15 1526/4885TSHR 3560/4885HSD17B10 2086/4885
US-20210009599-A1 THERAPEUTIC COMPOUNDS, COMPOSITIONS AND METHODS OF USE THEREOF JAK2, JAK1, JAK3 ALOX15 557/4885TSHR 4221/4885HSD17B10 1929/4885

“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.