SCHEMBL7175135

SCHEMBL7175135

C[P+](C)(C)C.C[P+](C)(C)C.[O-]B([O-])[O-].c1ccc(C[P+](Cc2ccccc2)(Cc2ccccc2)Cc2ccccc2)cc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SIGMAR1 Q99720 6/20 0.46
TAAR1 Q96RJ0 5/20 0.46
SLC6A2 P23975 3/20 0.46
SLC6A4 P31645 2/20 0.46
SLC6A3 Q01959 2/20 0.46
MAOA P21397 1/20 0.46
CYP2A6 P11509 1/20 0.46
ADORA2A P29274 1/20 0.46
ADORA1 P30542 1/20 0.46
SLC18A2 Q05940 1/20 0.43
CYP2D6 P10635 1/20 0.43
TRPA1 O75762 2/20 0.42
ADRA2B P18089 1/20 0.39
ADRA2C P18825 1/20 0.39
HTR2A P28223 1/20 0.39
ADRA1A P35348 1/20 0.39
OPRK1 P41145 1/20 0.39
KCNH2 Q12809 1/20 0.39
EPHX1 P07099 1/20 0.39
POLB P06746 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
SCHEMBL7171623 0.91 TRPA1 (0.44) SIGMAR1TAAR1SLC6A2SLC6A4SLC6A3
SCHEMBL7181573 0.91 EPHX1 (0.42) SIGMAR1TAAR1SLC6A2SLC6A4SLC6A3
SCHEMBL7181576 0.84 CA1 (0.43) SIGMAR1TAAR1SLC6A2SLC6A4SLC6A3
SCHEMBL7194414 0.84 CA1 (0.43) SIGMAR1TAAR1SLC6A2SLC6A4SLC6A3
SCHEMBL7175865 0.84 SIGMAR1 (0.48) SIGMAR1TAAR1SLC6A2SLC6A4SLC6A3
SCHEMBL7175078 0.82 SIGMAR1 (0.46) SIGMAR1TAAR1SLC6A2SLC6A4SLC6A3
SCHEMBL7183353 0.82 SIGMAR1 (0.46) SIGMAR1TAAR1SLC6A2SLC6A4SLC6A3
SCHEMBL7181583 0.82 SIGMAR1 (0.46) SIGMAR1TAAR1SLC6A2SLC6A4SLC6A3
Phenol SCHEMBL18009564 0.81 EPHX1 (0.42) SIGMAR1TAAR1SLC6A2SLC6A4SLC6A3
Bromide SCHEMBL5091934 0.80 EPHX1 (0.50) SIGMAR1TAAR1SLC6A2SLC6A4SLC6A3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1275694-A1 AROMATIC POLYCARBONATE COMPOSITION, PROCESS FOR PRODUCING THE SAME, AND MOLDED ARTICLE THEREOF TEIJIN LIMITED (JP) 2003-01-15 EP disclosed
US-20020103328-A1 Aromatic polycarbonate composition, production process therefor and molded product thereof TEIJIN LIMITED 2002-08-01 US disclosed