SCHEMBL9486229

SCHEMBL9486229

COc1ccc(CP(=O)(Cl)Cc2ccc(OC)cc2)cc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CMA1 P23946 1/20 0.50
IDO1 P14902 3/20 0.48
GSK3A P49840 1/20 0.47
GSK3B P49841 1/20 0.47
CA12 O43570 1/20 0.46
CA1 P00915 1/20 0.46
CA2 P00918 1/20 0.46
CA7 P43166 1/20 0.46
CA9 Q16790 1/20 0.46
CA14 Q9ULX7 1/20 0.46
ALDH1A1 P00352 2/20 0.46
ALOX15 P16050 2/20 0.46
KDM4E B2RXH2 1/20 0.46
MAPT P10636 1/20 0.46
AGXT P21549 2/20 0.45
LTA4H P09960 1/20 0.45
TAAR1 Q96RJ0 1/20 0.45
HTT P42858 1/20 0.44
LDHA P00338 1/20 0.44
TP53 P04637 1/20 0.44

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
SCHEMBL9687342 0.83 IDO1 (0.52) CMA1IDO1GSK3AGSK3BCA12
SCHEMBL12218512 0.79 IDO1 (0.48) CMA1IDO1GSK3AGSK3BCA12
SCHEMBL11123144 0.79 ANPEP (0.49) CMA1IDO1GSK3BCA12CA1
SCHEMBL914654 0.79 ANPEP (0.53) IDO1HTTLDHAF2RL1
Butane SCHEMBL3373014 0.75 ENPP2 (0.54) IDO1HTTLDHAF2RL1
SCHEMBL914036 0.75 IDO1 (0.44) CMA1IDO1CA12CA1CA2
SCHEMBL914509 0.73 ANPEP (0.44) IDO1ALDH1A1MAPTHTTLDHA
SCHEMBL5130903 0.73 MEN1 (0.59) ALDH1A1MAPTLTA4HHTTTP53
SCHEMBL12467622 0.73 LDHA (0.47) IDO1ALDH1A1HTTLDHATSHR
SCHEMBL28701098 0.72 KLK8 (0.57) LTA4HHTTTP53

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0269395-B1 RUTHENIUM-PHOSPHINE COMPLEX CATALYSTS Takasago International Corporation (JP) 1993-02-17 EP disclosed
EP-0271311-B1 RUTHENIUM-PHOSPHINE COMPLEXES Takasago International Corporation (JP) 1993-02-17 EP disclosed
EP-0271310-B1 RUTHENIUM-PHOSPHINE COMPLEXES Takasago International Corporation (JP) 1993-02-03 EP disclosed
US-4766227-A Ruthenium-phosphine complex TAKASAGO INTERNATIONAL CORPORATION (JP) 1988-08-23 US disclosed
US-4766225-A Ruthenium-phosphine complex TAKASAGO INTERNATIONAL CORPORATION (JP) 1988-08-23 US disclosed
US-4764629-A Ruthenium-phosphine complex TAKASAGO INTERNATIONAL CORPORATION (JP) 1988-08-16 US disclosed
EP-0271310-A2 Ruthenium-phosphine complexes Takasago International Corporation (JP) 1988-06-15 EP disclosed
EP-0271311-A2 Ruthenium-phosphine complexes Takasago International Corporation (JP) 1988-06-15 EP disclosed
EP-0269395-A2 Ruthenium-phosphine complex catalysts Takasago International Corporation (JP) 1988-06-01 EP disclosed