SCHEMBL8917524

SCHEMBL8917524

CC(=O)c1sc2cc(F)ccc2c1C1CC[N]CC1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 4/20 0.44
BCKDK O14874 1/20 0.43
NPC1 O15118 3/20 0.41
SMN1; SMN2 Q16637 3/20 0.41
TP53 P04637 2/20 0.41
ESR1 P03372 5/20 0.40
KDM4E B2RXH2 2/20 0.39
LMNA P02545 3/20 0.38
CASP3 P42574 2/20 0.38
ALDH1A1 P00352 2/20 0.38
MEN1 O00255 1/20 0.38
USP2 O75604 1/20 0.38
MAPT P10636 1/20 0.38
HPGD P15428 1/20 0.38
CASP1 P29466 1/20 0.38
HTT P42858 1/20 0.38
KMT2A Q03164 1/20 0.38
NPSR1 Q6W5P4 1/20 0.38
SENP8 Q96LD8 1/20 0.38
SENP7 Q9BQF6 1/20 0.38

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
SCHEMBL8919840 0.81 RAB9A (0.36) RAB9ABCKDKNPC1SMN1; SMN2TP53
SCHEMBL693361 0.79 BCKDK (0.60) RAB9ABCKDKNPC1SMN1; SMN2TP53
SCHEMBL912683 0.78 RAB9A (0.52) RAB9ABCKDKNPC1SMN1; SMN2TP53
SCHEMBL8920216 0.77 DRD2 (0.34) RAB9ABCKDKNPC1SMN1; SMN2TP53
SCHEMBL912462 0.77 RAB9A (0.49) RAB9ABCKDKNPC1SMN1; SMN2TP53
SCHEMBL2610281 0.76 BCKDK (0.57) RAB9ABCKDKNPC1SMN1; SMN2TP53
SCHEMBL7018371 0.75 BCKDK (0.49) RAB9ABCKDKTP53KDM4ELMNA
SCHEMBL4792978 0.73 BCKDK (0.53) RAB9ABCKDKNPC1SMN1; SMN2TP53
SCHEMBL4769753 0.72 HTR2A (0.45) RAB9ABCKDKNPC1SMN1; SMN2TP53
SCHEMBL4767198 0.72 CTSS (0.53) RAB9ABCKDKTP53LMNACASP3

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-5532240-A ANTIPSYCHOTIC AGENTS AND ANTISEROTONIN AGENTS YOSHITOMI PHARMACEUTICAL INDUSTRIES, LTD. (JP) 1996-07-02 US claimed
US-5691330-A ANTIPSYCHOTIC AGENT YOSHITOMI PHARMACEUTICAL INDUSTRIES, LTD. (JP) 1997-11-25 US disclosed
US-5532240-A ANTIPSYCHOTIC AGENTS AND ANTISEROTONIN AGENTS YOSHITOMI PHARMACEUTICAL INDUSTRIES, LTD. (JP) 1996-07-02 US disclosed