SCHEMBL3937145

SCHEMBL3937145

O=C(CC=Cc1ccccc1F)CN1CCN(CCCCl)CC1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 2/20 0.41
KMT2A Q03164 2/20 0.39
POLB P06746 1/20 0.39
CASP3 P42574 1/20 0.39
RAB9A P51151 1/20 0.39
SENP7 Q9BQF6 1/20 0.39
SENP6 Q9GZR1 1/20 0.39
ALDH1A1 P00352 4/20 0.39
HPGD P15428 1/20 0.39
NFE2L2 Q16236 2/20 0.39
MEN1 O00255 1/20 0.38
RAD52 P43351 1/20 0.38
KDM4E B2RXH2 1/20 0.38
CYP3A4 P08684 1/20 0.37
GAA P10253 1/20 0.37
CYP2D6 P10635 1/20 0.37
CYP2C9 P11712 1/20 0.37
CYP2C19 P33261 1/20 0.37
KEAP1 Q14145 1/20 0.36
LMNA P02545 2/20 0.35

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
SCHEMBL3934180 0.87 TDP1 (0.38) L3MBTL1KMT2APOLBRAB9AALDH1A1
SCHEMBL3937178 0.87 NFE2L2 (0.46) L3MBTL1KMT2APOLBRAB9AALDH1A1
SCHEMBL3934665 0.82 KMT2A (0.47) L3MBTL1KMT2ARAB9AALDH1A1KDM4E
SCHEMBL1399110 0.78 F2R (0.46) L3MBTL1KMT2APOLBNFE2L2MEN1
SCHEMBL3943715 0.78 ALDH1A1 (0.44) L3MBTL1KMT2AALDH1A1HPGDMEN1
SCHEMBL1399112 0.78 F2R (0.46) L3MBTL1KMT2APOLBNFE2L2MEN1
SCHEMBL3945177 0.69 MAPT (0.49) KMT2APOLBALDH1A1MEN1KDM4E
SCHEMBL3935366 0.68 F2R (0.45) KMT2AMEN1
SCHEMBL3935485 0.68 ALDH1A1 (0.54) L3MBTL1KMT2ARAB9AALDH1A1MEN1
SCHEMBL8828323 0.68 PAM (0.58) RAB9ANFE2L2CYP3A4CYP2D6CYP2C9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2046748-A1 PHENYLPENTADIENOYL DERIVATIVES AND THEIR USE AS PAR 1 ANTAGONISTS Pierre Fabre Medicament (FR) 2009-04-15 EP claimed
WO-2007147822-A1 PHENYLPENTADIENOYL DERIVATIVES AND THEIR USE AS PAR 1 ANTAGONISTS PIERRE FABRE MEDICAMENT (FR) 2007-12-27 WO claimed