SCHEMBL8920077

SCHEMBL8920077

Cc1ccc2scc(C3CC[N]CC3)c2c1

nearest known ligand 0.45

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
MAPT P10636 12/20 0.45
TP53 P04637 7/20 0.45
THRB P10828 2/20 0.45
CA2 P00918 1/20 0.39
USP2 O75604 2/20 0.38
DRD2 P14416 1/20 0.38
SLC6A4 P31645 1/20 0.38
POLB P06746 1/20 0.38
LMNA P02545 1/20 0.36
CYP17A1 P05093 1/20 0.34
CYP2A6 P11509 1/20 0.33
UTS2R Q9UKP6 2/20 0.32
FFAR1 O14842 1/20 0.32

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
SCHEMBL8916906 0.88 DRD2 (0.38) MAPTTP53THRBCA2USP2
SCHEMBL22860683 0.82 SLC6A4 (0.45) MAPTTP53THRBCA2USP2
SCHEMBL22860673 0.81 MAPT (0.52) MAPTTP53THRBCA2USP2
SCHEMBL4676653 0.78 SLC6A4 (0.55) MAPTTP53DRD2SLC6A4CYP2A6
SCHEMBL8917725 0.73 AVPR2 (0.39) MAPTTP53THRBCA2DRD2
SCHEMBL1365641 0.72 DRD2 (0.42) DRD2
SCHEMBL5543574 0.72 GRM7 (0.39) TP53SLC6A4
SCHEMBL8919052 0.70 MAPT (0.58) MAPTTP53THRBUSP2POLB
SCHEMBL8920622 0.70 ALDH1A1 (0.39) MAPTTHRBUSP2DRD2SLC6A4
SCHEMBL8991823 0.70 DRD2 (0.35) DRD2SLC6A4

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