SCHEMBL20446704

SCHEMBL20446704

CCOc1ccccc1/C=C/C(N)=O

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 6/20 0.62
▸ MAPT P10636 4/20 0.62
▸ SMN1; SMN2 Q16637 2/20 0.62
▸ ATM Q13315 1/20 0.62
▸ MCL1 Q07820 1/20 0.57
▸ KDM4E B2RXH2 3/20 0.56
▸ CYP1A2 P05177 1/20 0.56
▸ CYP2C9 P11712 1/20 0.56
▸ MEN1 O00255 1/20 0.56
▸ KMT2A Q03164 1/20 0.56
▸ AR P10275 2/20 0.55
▸ NFE2L2 Q16236 2/20 0.51
▸ TFEB P19484 1/20 0.50
▸ PTGER1 P34995 1/20 0.49
▸ PTGER4 P35408 1/20 0.49
▸ PTGER3 P43115 1/20 0.49
▸ PTGER2 P43116 1/20 0.49
▸ ALDH1A1 P00352 2/20 0.48
▸ PKM P14618 1/20 0.48
▸ HTT P42858 1/20 0.48

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
SCHEMBL28300287 1.00 LMNA (0.62) LMNAMAPTSMN1; SMN2ATMMCL1
SCHEMBL29857458 0.89 LMNA (0.60) LMNAMAPTSMN1; SMN2ATMMCL1
SCHEMBL1536281 0.85 PTGER1 (0.66) LMNAMAPTSMN1; SMN2ATMKDM4E
SCHEMBL11341981 0.85 KDM4E (0.68) LMNAMAPTSMN1; SMN2ATMKDM4E
SCHEMBL11327707 0.85 KDM4E (0.68) LMNAMAPTSMN1; SMN2ATMKDM4E
SCHEMBL1536282 0.85 PTGER1 (0.66) LMNAMAPTSMN1; SMN2ATMKDM4E
SCHEMBL9716952 0.85 LMNA (0.61) LMNAMAPTSMN1; SMN2ATMKDM4E
SCHEMBL16817700 0.85 KDM4E (0.60) LMNAMAPTSMN1; SMN2ATMMCL1
SCHEMBL9789403 0.84 LMNA (0.66) LMNAMAPTSMN1; SMN2ATMKDM4E
SCHEMBL9789400 0.84 LMNA (0.66) LMNAMAPTSMN1; SMN2ATMKDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3356356-A1 COMPOUNDS USEFUL AS MODULATORS OF TRPM8 Senomyx, Inc. (US) 2018-08-08 — — EP disclosed
Send feedback