SCHEMBL9748480

SCHEMBL9748480

O=C(c1cccc(OCc2ccccc2)c1)C(O)Cc1ccccc1

nearest known ligand 0.67

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
NR4A2 P43354 6/20 0.67
MAOB P27338 1/20 0.63
GPR132 Q9UNW8 2/20 0.62
SMPD1 P17405 2/20 0.60
SRD5A2 P31213 1/20 0.59
PTPN1 P18031 1/20 0.58
MEN1 O00255 1/20 0.54
KMT2A Q03164 1/20 0.54
NR1H4 Q96RI1 1/20 0.53
MRGPRX4 Q96LA9 1/20 0.52
ALDH1A1 P00352 1/20 0.52
FFAR1 O14842 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
SCHEMBL9748476 0.92 NR4A2 (0.62) NR4A2MAOBGPR132SMPD1SRD5A2
SCHEMBL14490205 0.84 MAOB (0.69) NR4A2MAOBGPR132SMPD1SRD5A2
SCHEMBL3362951 0.83 NR4A2 (0.70) NR4A2MAOBGPR132SMPD1SRD5A2
SCHEMBL20364678 0.83 MAOB (0.71) NR4A2MAOBGPR132SMPD1SRD5A2
SCHEMBL5775340 0.82 NR4A2 (0.65) NR4A2MAOBGPR132SMPD1SRD5A2
SCHEMBL27576886 0.82 MAOB (0.61) NR4A2MAOBGPR132SMPD1SRD5A2
SCHEMBL9748714 0.81 MDM2 (0.50) MEN1KMT2AALDH1A1
SCHEMBL11033672 0.81 MAOB (0.68) NR4A2MAOBGPR132SMPD1SRD5A2
SCHEMBL339009 0.81 NR4A2 (1.00) NR4A2MAOBSMPD1SRD5A2PTPN1
SCHEMBL30207018 0.81 NR4A2 (1.00) NR4A2MAOBSMPD1SRD5A2PTPN1

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
US-5120874-A Process for the preparation of 5-hydroxydiprafenone and its acid addition salts HELOPHARM W. PETRIK GMBH & CO. KG (DE) 1992-06-09 US claimed
EP-0283540-B1 PROCESS FOR THE PREPARATION OF 5-HYDROXYDIPRAPHENONE AND ITS SALTS WITH ACIDS Helopharm W. Petrik GmbH & Co.KG. (DE) 1991-09-18 EP claimed
US-5120874-A Process for the preparation of 5-hydroxydiprafenone and its acid addition salts HELOPHARM W. PETRIK GMBH & CO. KG (DE) 1992-06-09 US disclosed