SCHEMBL8918059

SCHEMBL8918059

CCc1c(CCN2CCN(c3coc4ccc(F)cc34)CC2)sc2c1CCN(C(C)=O)C2

nearest known ligand 0.37

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.37
TP53 P04637 2/20 0.37
GAA P10253 2/20 0.37
BRD3 Q15059 3/20 0.36
BAZ2B Q9UIF8 1/20 0.35
THRB P10828 1/20 0.35
MEN1 O00255 1/20 0.35
KMT2A Q03164 1/20 0.35
LMNA P02545 2/20 0.34
POLB P06746 1/20 0.34
HTR3A P46098 1/20 0.33

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
SCHEMBL8916688 0.94 MAPT (0.37) MAPTTP53GAABRD3BAZ2B
SCHEMBL8917688 0.91 MAPT (0.37) MAPTTP53BRD3BAZ2BMEN1
SCHEMBL8917921 0.87 MAPT (0.37) MAPTTP53BRD3BAZ2BTHRB
SCHEMBL8919168 0.85 TP53 (0.49) MAPTTP53GAABAZ2BTHRB
SCHEMBL8916598 0.84 TP53 (0.36) MAPTTP53GAABRD3THRB
SCHEMBL8916431 0.84 TP53 (0.38) MAPTTP53GAABRD3THRB
SCHEMBL8916994 0.83 HTR2A (0.43) MAPTTP53GAABAZ2BMEN1
SCHEMBL8915761 0.82 MAPT (0.39) MAPTTP53GAABRD3THRB
SCHEMBL8920013 0.82 TP53 (0.39) MAPTTP53GAABRD3THRB
SCHEMBL8916164 0.81 CTSS (0.48) MAPTTP53GAA

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