SCHEMBL7795655

SCHEMBL7795655

c1ccc(-c2cccc(P(c3ccccc3)c3ccccc3)c2-c2ccc3ccccc3c2)cc1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HDAC4 P56524 1/20 0.43
HDAC2 Q92769 1/20 0.43
HDAC8 Q9BY41 1/20 0.43
GSTP1 P09211 1/20 0.42
HSD17B1 P14061 1/20 0.40
HSD17B2 P37059 1/20 0.40
CYP1A1 P04798 1/20 0.40
CYP1B1 Q16678 1/20 0.40
ADORA2A P29274 2/20 0.38
ADORA1 P30542 2/20 0.38
CYP1A2 P05177 3/20 0.38
CYP2D6 P10635 1/20 0.38
CYP2C9 P11712 1/20 0.38
TSHR P16473 1/20 0.38
CYP2C19 P33261 1/20 0.38
SOS1 Q07889 1/20 0.38
HIF1A Q16665 1/20 0.38
PTGS2 P35354 1/20 0.36
SLC6A2 P23975 1/20 0.36
SLC6A4 P31645 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
SCHEMBL28441615 0.84 GSTP1 (0.50) HDAC4HDAC2HDAC8GSTP1HSD17B1
SCHEMBL30128001 0.84 GSTP1 (0.50) HDAC4HDAC2HDAC8GSTP1HSD17B1
SCHEMBL19664922 0.84 TDP1 (0.42) HDAC4HDAC2HDAC8PTGS2KDM4E
SCHEMBL4005844 0.84 GSTP1 (0.53) HDAC4HDAC2HDAC8GSTP1HSD17B1
Biphenyl SCHEMBL4005991 0.82 GSTP1 (0.52) HDAC4HDAC2HDAC8GSTP1HSD17B1
SCHEMBL19305535 0.82 TDP1 (0.41) HDAC4HDAC2HDAC8PTGS2KDM4E
SCHEMBL1768199 0.79 TDP1 (0.41) HDAC4HDAC2HDAC8PTGS2KDM4E
SCHEMBL4007611 0.78 GSTP1 (0.55) HDAC4HDAC2HDAC8GSTP1HSD17B1
SCHEMBL7795653 0.78 MAPT (0.43) HDAC8CYP2C9TSHRCYP2C19KDM4E
SCHEMBL31158582 0.78 MAPT (0.43) HDAC8CYP2C9TSHRCYP2C19KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-8245663-A None JP disclosed
EP-0731105-B1 Optically active tertiary phosphine compounds, transition metal complexes comprising the same as ligands and process for preparing optically active organic silicon compounds using said transition metal complexes SUMITOMO CHEMICAL CO (JP) 2001-12-05 EP disclosed
US-5621129-A Optically active tertiary phosphine compound, transition metal complex comprising the same as ligand and process for preparing optically active organic silicon compound using said transition metal complex SUMITOMO CHEMICAL CO., LTD. (JP) 1997-04-15 US disclosed
JP-H08245663-A PHOSPHINE COMPOUND, TRANSITION METAL COMPLEX CONTAINING THE COMPOUND AS LIGAND AND ITS USE SUMITOMO CHEM CO LTD 1996-09-24 JP disclosed
EP-0731105-A1 Optically active tertiary phosphine compounds, transition metal complexes comprising the same as ligands and process for preparing optically active organic silicon compounds using said transition metal complexes SUMITOMO CHEMICAL COMPANY LIMITED (JP) 1996-09-11 EP disclosed