SCHEMBL10498355

SCHEMBL10498355

CCCCCCCCc1ccc(C=CC(=O)c2ccc(F)cc2)cc1

nearest known ligand 0.64

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
THRA P10827 5/20 0.64
THRB P10828 5/20 0.64
TNFRSF1A P19438 1/20 0.63
ATG4B Q9Y4P1 12/20 0.63
PLA2G1B P04054 10/20 0.63
CYP1A2 P05177 1/20 0.63
TDP1 Q9NUW8 1/20 0.63
RECQL P46063 1/20 0.63
MAOB P27338 1/20 0.59
MEN1 O00255 1/20 0.58
KMT2A Q03164 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
SCHEMBL10497946 0.99 TNFRSF1A (0.65) THRATHRBTNFRSF1AATG4BPLA2G1B
SCHEMBL10498079 0.91 THRA (0.69) THRATHRBATG4BPLA2G1BCYP1A2
SCHEMBL10497619 0.89 THRA (0.68) THRATHRBATG4BPLA2G1BCYP1A2
SCHEMBL9342522 0.88 THRA (0.66) THRATHRBATG4BPLA2G1BCYP1A2
SCHEMBL9342489 0.88 THRA (0.66) THRATHRBATG4BPLA2G1BCYP1A2
SCHEMBL9338015 0.88 THRA (0.66) THRATHRBATG4BPLA2G1BCYP1A2
SCHEMBL9342084 0.88 THRA (0.66) THRATHRBATG4BPLA2G1BCYP1A2
SCHEMBL9338749 0.88 THRA (0.66) THRATHRBATG4BPLA2G1BCYP1A2
SCHEMBL9338132 0.88 THRA (0.66) THRATHRBATG4BPLA2G1BCYP1A2
SCHEMBL9342252 0.88 THRA (0.66) THRATHRBATG4BPLA2G1BCYP1A2

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
EP-0328669-A1 CHALCONE DERIVATIVE COMPOUNDS NIPPON OIL AND FATS COMPANY, LIMITED (JP) 1989-08-23 EP claimed
EP-0328669-A1 CHALCONE DERIVATIVE COMPOUNDS NIPPON OIL AND FATS COMPANY, LIMITED (JP) 1989-08-23 EP disclosed