SCHEMBL9019934

SCHEMBL9019934

CON=C(C(=O)OC)c1cccc(OCc2ccccc2)c1

nearest known ligand 0.71

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
HIF1A Q16665 7/20 0.71
MAOB P27338 1/20 0.61
NR4A2 P43354 3/20 0.60
SMPD1 P17405 3/20 0.59
PTPN1 P18031 1/20 0.56
SRD5A2 P31213 1/20 0.54
MEN1 O00255 1/20 0.53
KMT2A Q03164 1/20 0.53
NR1H4 Q96RI1 1/20 0.52
MRGPRX4 Q96LA9 1/20 0.51
GPR132 Q9UNW8 1/20 0.51

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
SCHEMBL9019947 0.83 HIF1A (0.67) HIF1AMAOBNR4A2PTPN1MRGPRX4
SCHEMBL9019897 0.83 MAOB (0.69) HIF1AMAOBNR4A2SMPD1PTPN1
SCHEMBL9660188 0.81 CES2 (0.57) HIF1AMEN1KMT2A
SCHEMBL9660191 0.81 CES2 (0.57) HIF1AMEN1KMT2A
SCHEMBL8354367 0.81 MAOB (0.66) HIF1AMAOBNR4A2SMPD1PTPN1
SCHEMBL976424 0.80 MAOB (0.73) MAOBNR4A2SMPD1PTPN1SRD5A2
SCHEMBL30412034 0.80 MAOB (0.73) MAOBNR4A2SMPD1PTPN1SRD5A2
SCHEMBL31130421 0.80 PTPN1 (0.78) MAOBNR4A2SMPD1PTPN1SRD5A2
SCHEMBL8881912 0.78 HIF1A (0.65) HIF1AMEN1KMT2A
SCHEMBL8881918 0.78 HIF1A (0.65) HIF1AMEN1KMT2A

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