SCHEMBL8916959

SCHEMBL8916959

CCc1c(CCN2CCN(c3csc4cccc(C)c34)CC2)sc2c1CCN(C(C)=O)C2

nearest known ligand 0.39

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
TP53 P04637 6/20 0.39
MAPT P10636 5/20 0.39
POLB P06746 1/20 0.39
HTR3A P46098 2/20 0.36
THRB P10828 1/20 0.36
HTR1A P08908 3/20 0.34
ADRA1D P25100 1/20 0.34
HTR1B P28222 1/20 0.34
ADRA1A P35348 1/20 0.34
ADRA1B P35368 1/20 0.34
GAA P10253 1/20 0.34
DRD2 P14416 1/20 0.34
HTR2A P28223 1/20 0.34

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
SCHEMBL8919144 0.91 TP53 (0.38) TP53MAPTPOLBHTR3ATHRB
SCHEMBL8918541 0.87 TP53 (0.38) TP53MAPTPOLBHTR3ATHRB
SCHEMBL8917325 0.86 MAPT (0.40) TP53MAPTPOLBTHRBGAA
SCHEMBL8920013 0.85 TP53 (0.39) TP53MAPTPOLBHTR3ATHRB
SCHEMBL8916455 0.84 MAPT (0.44) TP53MAPTPOLBTHRB
SCHEMBL8915765 0.84 MAPT (0.38) TP53MAPTPOLBHTR3ATHRB
SCHEMBL8915761 0.82 MAPT (0.39) TP53MAPTPOLBHTR3ATHRB
SCHEMBL8919168 0.82 TP53 (0.49) TP53MAPTTHRBHTR1AADRA1A
SCHEMBL8916994 0.82 HTR2A (0.43) TP53MAPTHTR1AADRA1AGAA
SCHEMBL8917290 0.82 TP53 (0.36) TP53MAPTPOLBHTR3ATHRB

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
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