SCHEMBL20146003

SCHEMBL20146003

Cc1cc(C)cc(C(=O)N(NC(=O)c2cccc(C)c2F)C(C)(C)C)c1

nearest known ligand 0.78

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
ABCB1 P08183 7/20 0.77
CYP3A4 P08684 1/20 0.55

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
SCHEMBL10721974 0.90 ABCB1 (0.70) ABCB1CYP3A4
SCHEMBL8461192 0.88 ABCB1 (0.81) ABCB1CYP3A4
SCHEMBL32672049 0.88 ABCB1 (0.81) ABCB1CYP3A4
SCHEMBL16077537 0.87 ABCB1 (0.65) ABCB1CYP3A4
SCHEMBL10718829 0.86 ABCB1 (0.79) ABCB1CYP3A4
SCHEMBL10720118 0.85 ABCB1 (0.77) ABCB1CYP3A4
SCHEMBL10721508 0.85 ABCB1 (0.77) ABCB1CYP3A4
SCHEMBL28340060 0.83 ABCB1 (0.74) ABCB1CYP3A4
SCHEMBL16077544 0.82 ABCB1 (0.72) ABCB1CYP3A4
SCHEMBL10718745 0.82 ABCB1 (0.64) ABCB1CYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2970106-B1 BORON-CONTAINING DIACYLHYDRAZINES INTREXON CORP (US) 2018-05-16 EP disclosed