SCHEMBL8919144

SCHEMBL8919144

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

nearest known ligand 0.38

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
TP53 P04637 8/20 0.38
THRB P10828 2/20 0.38
MAPT P10636 7/20 0.38
GAA P10253 1/20 0.37
HTR3A P46098 2/20 0.36
POLB P06746 1/20 0.34
HTR1A P08908 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
SCHEMBL8916959 0.91 TP53 (0.39) TP53THRBMAPTGAAHTR3A
SCHEMBL8917290 0.87 TP53 (0.36) TP53THRBMAPTGAAHTR3A
SCHEMBL8916431 0.85 TP53 (0.38) TP53THRBMAPTGAAHTR3A
SCHEMBL8919168 0.84 TP53 (0.49) TP53THRBMAPTGAAHTR1A
SCHEMBL8916994 0.84 HTR2A (0.43) TP53MAPTGAAHTR1A
SCHEMBL8916598 0.82 TP53 (0.36) TP53THRBMAPTGAAHTR3A
SCHEMBL8918541 0.82 TP53 (0.38) TP53THRBMAPTGAAHTR3A
SCHEMBL8915765 0.82 MAPT (0.38) TP53THRBMAPTHTR3APOLB
SCHEMBL8916455 0.82 MAPT (0.44) TP53THRBMAPTPOLB
SCHEMBL8917325 0.79 MAPT (0.40) TP53THRBMAPTGAAPOLB

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