SCHEMBL8611516

SCHEMBL8611516

Oc1ccc2ccccc2c1-c1ccccc1P(c1ccccc1)c1ccccc1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NSD2 O96028 1/20 0.44
OPRM1 P35372 1/20 0.44
OPRD1 P41143 1/20 0.44
HKDC1 Q2TB90 1/20 0.44
HSP90AA1 P07900 6/20 0.42
HSP90AB1 P08238 6/20 0.42
PTPN22 Q9Y2R2 1/20 0.42
POLB P06746 1/20 0.40
MCL1 Q07820 1/20 0.39
ACMSD Q8TDX5 1/20 0.39
HSD17B10 Q99714 2/20 0.39
USP2 O75604 1/20 0.39
PAK1 Q13153 1/20 0.39
CYP1A2 P05177 1/20 0.39
CYP2C9 P11712 1/20 0.39
CYP2C19 P33261 1/20 0.39
WDR5 P61964 1/20 0.38
KDM4E B2RXH2 1/20 0.37
ALDH1A1 P00352 1/20 0.37
GLA P06280 1/20 0.37

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
Dimethylamine SCHEMBL8611687 0.94 HSP90AA1 (0.41) NSD2OPRM1OPRD1HKDC1HSP90AA1
SCHEMBL8611708 0.88 HSP90AA1 (0.49) NSD2OPRM1OPRD1HKDC1HSP90AA1
SCHEMBL8611685 0.85 RRM1 (0.43) NSD2OPRM1OPRD1HKDC1HSP90AA1
SCHEMBL14193453 0.85 MAPT (0.44) NSD2OPRM1OPRD1HKDC1HSP90AA1
SCHEMBL6928512 0.84 PTPN22 (0.44) NSD2OPRM1OPRD1HKDC1HSP90AA1
SCHEMBL4004222 0.84 PTPN22 (0.44) NSD2OPRM1OPRD1HKDC1HSP90AA1
SCHEMBL8610248 0.81 CYP1A2 (0.40) NSD2OPRM1OPRD1HKDC1HSP90AA1
SCHEMBL8613773 0.81 P2RX1 (0.39) NSD2OPRM1OPRD1HKDC1HSP90AA1
SCHEMBL8612267 0.79 HSP90AA1 (0.40) NSD2OPRM1OPRD1HKDC1HSP90AA1
SCHEMBL29125513 0.79 WDR5 (0.43) MCL1ACMSDWDR5KDM4EALDH1A1

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
US-5789623-A Process for the preparation of hydroxybiarylphosphines and novel compounds of this group of substances HOECHST AKTIENGESELLSCHAFT (DE) 1998-08-04 US disclosed
EP-0748811-A1 Process for the preparation of hydroxybiarylphosphanes and novel compounds from this materials group HOECHST AKTIENGESELLSCHAFT (DE) 1996-12-18 EP disclosed