SCHEMBL9338595

SCHEMBL9338595

CCCCCCCCCCCCCCCCCCc1ccc(C(=O)C=Cc2ccc(C)cc2)cc1

nearest known ligand 0.66

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
THRA P10827 5/20 0.66
THRB P10828 5/20 0.66
MAPT P10636 2/20 0.65
ATG4B Q9Y4P1 12/20 0.64
PLA2G1B P04054 10/20 0.64
CYP1A2 P05177 1/20 0.64
TDP1 Q9NUW8 1/20 0.64
RECQL P46063 1/20 0.64
MEN1 O00255 1/20 0.59
KMT2A Q03164 1/20 0.59
POLB P06746 1/20 0.58
MAOA P21397 1/20 0.58
MAOB P27338 1/20 0.58
RAB9A P51151 1/20 0.58

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
SCHEMBL9338015 1.00 THRA (0.66) THRATHRBMAPTATG4BPLA2G1B
SCHEMBL9342084 1.00 THRA (0.66) THRATHRBMAPTATG4BPLA2G1B
SCHEMBL9338132 1.00 THRA (0.66) THRATHRBMAPTATG4BPLA2G1B
SCHEMBL9342489 1.00 THRA (0.66) THRATHRBMAPTATG4BPLA2G1B
SCHEMBL9342252 1.00 THRA (0.66) THRATHRBMAPTATG4BPLA2G1B
SCHEMBL9342522 1.00 THRA (0.66) THRATHRBMAPTATG4BPLA2G1B
SCHEMBL9338749 1.00 THRA (0.66) THRATHRBMAPTATG4BPLA2G1B
SCHEMBL18762730 0.99 MAPT (0.67) THRATHRBMAPTATG4BPLA2G1B
SCHEMBL18762727 0.99 MAPT (0.67) THRATHRBMAPTATG4BPLA2G1B
SCHEMBL9337982 0.94 MAPT (0.69) THRATHRBMAPTATG4BPLA2G1B

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0328668-B1 NONLINEAR OPTICAL MATERIAL NIPPON OILS & FATS CO LTD (JP) 1994-05-25 EP disclosed
US-5045239-A Chalcone derivative NIPPON OIL AND FATS CO., LTD. (JP) 1991-09-03 US disclosed
EP-0328668-A1 NONLINEAR OPTICAL MATERIAL NIPPON OIL AND FATS COMPANY, LIMITED (JP) 1989-08-23 EP disclosed
EP-0328669-A1 CHALCONE DERIVATIVE COMPOUNDS NIPPON OIL AND FATS COMPANY, LIMITED (JP) 1989-08-23 EP disclosed