SCHEMBL7552025

SCHEMBL7552025

Cc1cc(OS(=O)(=O)C(F)(F)F)c(-c2c(P(c3ccccc3)c3ccccc3)cc(C)c(Cl)c2C)c(C)c1Cl

nearest known ligand 0.31

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
ADORA2A P29274 1/20 0.31
ADORA1 P30542 1/20 0.31
EPAS1 Q99814 2/20 0.31
DRD2 P14416 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
SCHEMBL7029405 0.84 EPAS1 (0.36) ADORA2AADORA1EPAS1DRD2
SCHEMBL5896833 0.80 CYP3A4 (0.38)
SCHEMBL7580596 0.79 EPAS1 (0.37) ADORA2AADORA1EPAS1DRD2
SCHEMBL19009972 0.77 HSD11B1 (0.30)
SCHEMBL7033701 0.76 KMT2A (0.36) ADORA2AADORA1EPAS1DRD2
SCHEMBL7030626 0.72 GAA (0.39)
SCHEMBL7030271 0.71 DRD2 (0.32) EPAS1DRD2
SCHEMBL8647653 0.70 DRD2 (0.34) ADORA2AADORA1EPAS1DRD2
SCHEMBL5897025 0.68 MAPT (0.32)
SCHEMBL13338228 0.67 CYP3A4 (0.33) DRD2

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-0826691-B1 Optically active diphosphine compound, method for making the compound, transition metal complex having the compound as ligand and method for making optically active substance by use of the complex TAKASAGO PERFUMERY CO LTD (JP) 2002-07-10 EP disclosed
US-5847222-A Optically active diphosphine compound, method for making the compound, transition metal complex having the compound as ligand and method for making optically active substance by use of the complex TAKASAGO INTERNATIONAL CORPORATION (JP) 1998-12-08 US disclosed
EP-0826691-A2 Optically active diphosphine compound, method for making the compound, transition metal complex having the compound as ligand and method for making optically active substance by use of the complex Takasago International Corporation (JP) 1998-03-04 EP disclosed