SCHEMBL8614154

SCHEMBL8614154

CC(C)P(c1ccc2ccccc2c1-c1ccccc1O)C(C)C

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NSD2 O96028 1/20 0.41
OPRM1 P35372 1/20 0.41
OPRD1 P41143 1/20 0.41
HKDC1 Q2TB90 1/20 0.41
CYP1A2 P05177 2/20 0.40
DNMT1 P26358 1/20 0.40
MAPT P10636 7/20 0.40
TSHR P16473 2/20 0.40
PTPN22 Q9Y2R2 1/20 0.38
KMT2A Q03164 5/20 0.37
MEN1 O00255 4/20 0.37
CYP2C19 P33261 3/20 0.37
CYP3A4 P08684 2/20 0.37
CYP2C9 P11712 2/20 0.37
TP53 P04637 1/20 0.37
CYP2D6 P10635 1/20 0.37
ALDH1A1 P00352 3/20 0.36
KDM4E B2RXH2 2/20 0.36
HPGD P15428 1/20 0.36
RECQL P46063 1/20 0.36

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
SCHEMBL8611033 0.84 MAPT (0.47) NSD2OPRM1OPRD1HKDC1CYP1A2
SCHEMBL8609119 0.81 NSD2 (0.48) NSD2OPRM1OPRD1HKDC1CYP1A2
SCHEMBL8610248 0.78 CYP1A2 (0.40) NSD2OPRM1OPRD1HKDC1CYP1A2
SCHEMBL8611852 0.78 NSD2 (0.39) NSD2OPRM1OPRD1HKDC1CYP1A2
SCHEMBL8610168 0.77 MAPT (0.46) MAPTTSHRKMT2AMEN1CYP3A4
Dimethylamine SCHEMBL8615987 0.77 HSP90AA1 (0.36) NSD2OPRM1OPRD1HKDC1CYP1A2
SCHEMBL6403846 0.76 NSD2 (0.54) NSD2OPRM1OPRD1HKDC1CYP1A2
SCHEMBL249793 0.75 CYP1A2 (0.48) NSD2OPRM1OPRD1HKDC1CYP1A2
SCHEMBL18174238 0.75 POLB (0.50) NSD2OPRM1OPRD1HKDC1CYP1A2
SCHEMBL8615638 0.74 ALDH1A1 (0.40) MAPTTSHRKMT2AMEN1CYP3A4

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