SCHEMBL7795643

SCHEMBL7795643

COc1ccc(P(c2ccc(OC)cc2)c2ccc3ccccc3c2-c2cccc3ccccc23)cc1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.45
RAB9A P51151 3/20 0.42
KMT2A Q03164 2/20 0.42
MEN1 O00255 1/20 0.42
ALDH1A1 P00352 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
CYP1A2 P05177 2/20 0.40
CYP11B1 P15538 2/20 0.40
CYP11B2 P19099 2/20 0.40
CYP3A4 P08684 1/20 0.40
CYP2D6 P10635 1/20 0.40
CYP2C9 P11712 1/20 0.40
CYP2B6 P20813 1/20 0.40
CYP2C19 P33261 1/20 0.40
FLT3 P36888 1/20 0.39
ALOX5 P09917 2/20 0.39
CDK4 P11802 1/20 0.39
CCND1 P24385 1/20 0.39
STAT3 P40763 1/20 0.38
CYP2A6 P11509 1/20 0.38

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
SCHEMBL301026 0.90 MAPT (0.51) MAPTRAB9AKMT2AMEN1ALDH1A1
SCHEMBL2949327 0.84 DHFR (0.40) MAPTRAB9AKMT2AMEN1ALDH1A1
SCHEMBL275907 0.84 DNMT1 (0.40) MAPTRAB9AKMT2AMEN1ALDH1A1
SCHEMBL29368065 0.84 DNMT1 (0.40) MAPTRAB9AKMT2AMEN1ALDH1A1
SCHEMBL30616100 0.84 DNMT1 (0.40) MAPTRAB9AKMT2AMEN1ALDH1A1
SCHEMBL30436853 0.82 DNMT1 (0.39) MAPTRAB9AKMT2AMEN1ALDH1A1
SCHEMBL8595804 0.82 DNMT1 (0.39) MAPTRAB9AKMT2AMEN1ALDH1A1
Hydrochloric Acid SCHEMBL5566890 0.82 DHFR (0.38) MAPTRAB9AKMT2AMEN1ALDH1A1
SCHEMBL12474165 0.81 TYMP (0.39) MAPTRAB9AKMT2AMEN1ALDH1A1
SCHEMBL7796060 0.81 DNMT1 (0.36) MAPTRAB9AKMT2AMEN1ALDH1A1

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
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
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
US-5532402-A Process for producing optically active hydroxyalkylphosphonates TAKASAGO INTERNATIONAL CORPORATION (JP) 1996-07-02 US disclosed