SCHEMBL7795653

SCHEMBL7795653

c1ccc(-c2cccc(P(c3ccccc3)c3ccccc3)c2-c2cccc3ccccc23)cc1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 5/20 0.43
KDM4E B2RXH2 4/20 0.43
ALDH1A1 P00352 4/20 0.43
HPGD P15428 4/20 0.43
SMN1; SMN2 Q16637 3/20 0.43
TDP1 Q9NUW8 3/20 0.43
MAPK1 P28482 2/20 0.43
HSD17B10 Q99714 2/20 0.43
L3MBTL1 Q9Y468 2/20 0.43
TP53 P04637 1/20 0.43
TSHR P16473 1/20 0.43
NFKB1 P19838 1/20 0.43
NFKB2 Q00653 1/20 0.43
RELA Q04206 1/20 0.43
ATM Q13315 1/20 0.43
CA12 O43570 2/20 0.40
CA1 P00915 2/20 0.40
CA2 P00918 2/20 0.40
CA9 Q16790 2/20 0.40
TNF P01375 1/20 0.39

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
SCHEMBL31158582 1.00 MAPT (0.43) MAPTKDM4EALDH1A1HPGDSMN1; SMN2
SCHEMBL1768199 0.84 TDP1 (0.41) KDM4EALDH1A1HPGDTDP1MAPK1
SCHEMBL30616100 0.83 DNMT1 (0.40) MAPTKDM4EALDH1A1HPGDSMN1; SMN2
SCHEMBL29368065 0.83 DNMT1 (0.40) MAPTKDM4EALDH1A1HPGDSMN1; SMN2
SCHEMBL275907 0.83 DNMT1 (0.40) MAPTKDM4EALDH1A1HPGDSMN1; SMN2
SCHEMBL19664922 0.83 TDP1 (0.42) MAPTKDM4EALDH1A1HPGDTDP1
SCHEMBL5805612 0.83 GPR84 (0.38) MAPTKDM4EALDH1A1HPGDSMN1; SMN2
SCHEMBL30436853 0.82 DNMT1 (0.39) MAPTKDM4EALDH1A1HPGDSMN1; SMN2
SCHEMBL8595804 0.82 DNMT1 (0.39) MAPTKDM4EALDH1A1HPGDSMN1; SMN2
SCHEMBL8418840 0.81 WDR5 (0.37) MAPTKDM4EALDH1A1HPGDSMN1; SMN2

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