SCHEMBL9019897

SCHEMBL9019897

COC(=O)C(=O)c1cccc(OCc2ccccc2)c1

nearest known ligand 0.69

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
MAOB P27338 2/20 0.69
NR4A2 P43354 2/20 0.68
SMPD1 P17405 3/20 0.66
PTPN1 P18031 1/20 0.63
SRD5A2 P31213 1/20 0.60
MEN1 O00255 2/20 0.58
KMT2A Q03164 2/20 0.58
NR1H4 Q96RI1 1/20 0.57
MRGPRX4 Q96LA9 1/20 0.57
GPR132 Q9UNW8 1/20 0.56
HPD P32754 1/20 0.55
GUSB P08236 1/20 0.55
HIF1A Q16665 1/20 0.55

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
SCHEMBL8354367 0.86 MAOB (0.66) MAOBNR4A2SMPD1PTPN1SRD5A2
SCHEMBL17978704 0.86 MAOB (0.66) MAOBNR4A2SMPD1PTPN1SRD5A2
SCHEMBL976424 0.85 MAOB (0.73) MAOBNR4A2SMPD1PTPN1SRD5A2
SCHEMBL30412034 0.85 MAOB (0.73) MAOBNR4A2SMPD1PTPN1SRD5A2
SCHEMBL8189375 0.85 NR4A2 (0.77) MAOBNR4A2SMPD1PTPN1SRD5A2
SCHEMBL31130421 0.85 PTPN1 (0.78) MAOBNR4A2SMPD1PTPN1SRD5A2
SCHEMBL9043616 0.84 MAOB (0.67) MAOBNR4A2PTPN1SRD5A2
SCHEMBL1122805 0.83 MRGPRX4 (0.71) MAOBNR4A2SMPD1PTPN1SRD5A2
SCHEMBL9019934 0.83 HIF1A (0.71) MAOBNR4A2SMPD1PTPN1SRD5A2
SCHEMBL8193954 0.82 NR4A2 (0.72) MAOBNR4A2SMPD1PTPN1SRD5A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0422597-B1 Derivatives of phenylacetic acid and fungicides containing them BASF AG (DE) 1996-07-24 EP disclosed
US-5286750-A For crops or ornamental plants BASF AKTIENGESELLSCHAFT (DE) 1994-02-15 US disclosed
EP-0422597-A2 Derivatives of phenylacetic acid and fungicides containing them BASF Aktiengesellschaft (DE) 1991-04-17 EP disclosed