SCHEMBL7643769

SCHEMBL7643769

Cc1cc(C(C)(C)C)cc(C(C)(C)C)c1C(CCCCCCCCCCCCCCCCC[PH](O)(O)O)c1c(C)cc(C(C)(C)C)cc1C(C)(C)C

nearest known ligand 0.33

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
CYP2C9 P11712 2/20 0.33
CYP2C19 P33261 2/20 0.33
CYP1A2 P05177 1/20 0.33
CYP3A4 P08684 1/20 0.33
TSHR P16473 1/20 0.33
TP53 P04637 1/20 0.33
CYP2D6 P10635 1/20 0.33
ALOX15 P16050 1/20 0.33
ALDH1A1 P00352 1/20 0.31
HTR1D P28221 1/20 0.30
HTR1B P28222 1/20 0.30

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
SCHEMBL39016 0.80 CYP2C9 (0.37) CYP2C9CYP2C19CYP1A2CYP3A4TSHR
SCHEMBL2873123 0.79 CYP2C9 (0.35) CYP2C9CYP2C19CYP1A2CYP3A4TSHR
SCHEMBL7643760 0.77 CYP2C9 (0.32) CYP2C9CYP2C19CYP1A2CYP3A4TSHR
SCHEMBL17817752 0.76 CA2 (0.37) TSHRALDH1A1
SCHEMBL8913370 0.74 CYP2C9 (0.33) CYP2C9CYP2C19CYP1A2CYP3A4TSHR
SCHEMBL460101 0.73 ALDH1A1 (0.36) CYP2C9CYP2C19CYP1A2CYP3A4TSHR
SCHEMBL39338 0.72 POLB (0.36) CYP2C9CYP2C19CYP1A2CYP3A4TSHR
SCHEMBL10604028 0.71 TRAP1 (0.34) CYP2C9CYP2C19CYP1A2CYP3A4TSHR
SCHEMBL10605799 0.71 TRAP1 (0.34) CYP2C9CYP2C19CYP1A2CYP3A4TSHR
SCHEMBL11176766 0.71 ALDH1A1 (0.34) CYP2C9CYP2C19CYP1A2CYP3A4TSHR

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
EP-0856526-B1 OLEFIN (CO)POLYMER COMPOSITION, PROCESS FOR PRODUCING THE SAME, CATALYST FOR (CO)POLYMERIZING OLEFIN, AND PROCESS FOR PRODUCING THE SAME CHISSO CORP (JP) 2002-08-28 EP disclosed
US-6313225-B2 High melt tension, high crystallization temperature; hollow moldings CHISSO CORPORATION (JP) 2001-11-06 US disclosed
US-20010004657-A1 OLEFIN(CO-) POLYMER COMPOSITIONS AND METHOD FOR PRODUCING THE SAME ANDCATALYST FOR OLEFIN (CO-) POLYMERIZATION AND METHOD FOR PRODUCING THE SAME CHISSO CORPORATION (JP) 2001-06-21 US disclosed
US-6156845-A Polyolefin composition and method of making CHISSO CORPORATION (JP) 2000-12-05 US disclosed
EP-0856526-A1 OLEFIN (CO)POLYMER COMPOSITION, PROCESS FOR PRODUCING THE SAME, CATALYST FOR (CO)POLYMERIZING OLEFIN, AND PROCESS FOR PRODUCING THE SAME CHISSO CORPORATION (JP) 1998-08-05 EP disclosed