SCHEMBL7404875

SCHEMBL7404875

Cc1ccc(S(=O)(=O)NCc2ccc(C(=O)CN3CCN(c4ccncc4)CC3)cc2)cc1

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 2/20 0.61
OPRM1 P35372 1/20 0.58
NPC1 O15118 1/20 0.56
TNF P01375 1/20 0.56
PAX8 Q06710 1/20 0.56
NOD2 Q9HC29 1/20 0.56
NOD1 Q9Y239 1/20 0.56
LMNA P02545 5/20 0.56
SMN1; SMN2 Q16637 3/20 0.56
HTT P42858 2/20 0.56
ALDH1A1 P00352 5/20 0.56
MEN1 O00255 2/20 0.55
KMT2A Q03164 2/20 0.55
HPGD P15428 3/20 0.54
TSHR P16473 2/20 0.54
HSD17B10 Q99714 1/20 0.54
CA1 P00915 1/20 0.53
CA2 P00918 1/20 0.53
CA7 P43166 1/20 0.53
CA9 Q16790 1/20 0.53

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
SCHEMBL7399688 0.90 ALDH1A1 (0.57) RAB9AOPRM1NPC1TNFPAX8
SCHEMBL7400525 0.86 MEN1 (0.55) RAB9ANPC1LMNASMN1; SMN2HTT
SCHEMBL7401572 0.84 SMN1; SMN2 (0.60) RAB9AOPRM1NPC1TNFPAX8
SCHEMBL9516076 0.83 HRH3 (0.47) SMN1; SMN2HTTALDH1A1MEN1KMT2A
SCHEMBL7393627 0.81 HRH3 (0.47) OPRM1LMNAMEN1KMT2AHPGD
SCHEMBL9513528 0.78 CA1 (0.54) LMNASMN1; SMN2CA1CA2CA7
SCHEMBL7396524 0.77 MEN1 (0.53) RAB9ANPC1ALDH1A1MEN1KMT2A
SCHEMBL7956461 0.75 ALDH1A1 (0.54) RAB9ALMNASMN1; SMN2HTTALDH1A1
SCHEMBL9513736 0.75 POLB (0.49) SMN1; SMN2HTTALDH1A1MEN1KMT2A
SCHEMBL7400645 0.75 MEN1 (0.52) LMNASMN1; SMN2HTTALDH1A1MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5563141-A INHIBIT CELL ADHESION FOR EXAMPLE, PLATELET AGGRE GATION ZENECA LIMITED (GB) 1996-10-08 US disclosed
EP-0690847-A1 HETEROCYCLIC COMPOUNDS AS PLATELET AGGREGATION INHIBITORS ZENECA LIMITED (GB) 1996-01-10 EP disclosed
WO-1994022835-A2 HETEROCYCLIC COMPOUNDS AS PLATELET AGGREGATION INHIBITORS ZENECA LIMITED (GB) 1994-10-13 WO disclosed