SCHEMBL8961540

SCHEMBL8961540

C=C(Cc1ccccc1CC(=C)c1ccccc1)c1ccccc1.Cc1cccc(OCc2ccc(-c3ccccc3)cc2)c1

nearest known ligand 0.51

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
SMPD1 P17405 2/20 0.51
MAOB P27338 6/20 0.46
NR4A2 P43354 2/20 0.45
MRGPRX4 Q96LA9 2/20 0.45
HRH3 Q9Y5N1 1/20 0.44
ALOX5 P09917 1/20 0.43
TP53 P04637 1/20 0.43
POLB P06746 1/20 0.43
FFAR1 O14842 1/20 0.43
FFAR4 Q5NUL3 1/20 0.43
HPD P32754 1/20 0.42
PTGER4 P35408 1/20 0.41
F2 P00734 1/20 0.41

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
SCHEMBL52030 0.83 MAOB (0.57) SMPD1MAOBHRH3ALOX5TP53
SCHEMBL29378803 0.83 MAOB (0.57) SMPD1MAOBHRH3ALOX5TP53
SCHEMBL1702528 0.79 MAOB (0.62) SMPD1MAOBHRH3TP53POLB
SCHEMBL12900887 0.77 FFAR1 (0.58) SMPD1MAOBNR4A2ALOX5TP53
SCHEMBL685837 0.75 MAOB (0.68) MAOBNR4A2HRH3ALOX5
SCHEMBL1549250 0.75 MAOB (0.68) MAOBHRH3
SCHEMBL12635690 0.72 MAOB (0.60) MAOBNR4A2MRGPRX4TP53POLB
SCHEMBL9475292 0.72 GSTP1 (0.57) SMPD1MAOBFFAR1
SCHEMBL12182456 0.72 MAOB (0.74) MAOBHRH3HPD
SCHEMBL6121170 0.72 RXRA (0.69) MAOBNR4A2HRH3POLB

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-0599580-B1 Thermal recording sheet JUJO PAPER CO LTD (JP) 1996-02-07 EP disclosed
EP-0599580-A1 Thermal recording sheet NIPPON PAPER INDUSTRIES CO., LTD. (JP) 1994-06-01 EP disclosed