SCHEMBL9756443

SCHEMBL9756443

CC(C)(C)N(NC(=O)C1=CCC1)C(=O)c1ccccc1

nearest known ligand 0.70

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.70
CYP3A4 P08684 1/20 0.61
CYP2C9 P11712 1/20 0.61
SMN1; SMN2 Q16637 2/20 0.51
RECQL P46063 1/20 0.50
ABCB1 P08183 1/20 0.49
HPGD P15428 1/20 0.49

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
SCHEMBL8174421 0.89 POLB (0.63) POLBCYP3A4CYP2C9SMN1; SMN2RECQL
SCHEMBL9756440 0.89 POLB (0.70) POLBCYP3A4CYP2C9
SCHEMBL9756297 0.88 POLB (0.74) POLBCYP3A4CYP2C9SMN1; SMN2RECQL
SCHEMBL9756445 0.88 POLB (0.62) POLBCYP3A4CYP2C9SMN1; SMN2RECQL
SCHEMBL9756449 0.88 POLB (0.62) POLBCYP3A4CYP2C9SMN1; SMN2RECQL
SCHEMBL9756452 0.88 POLB (0.62) POLBCYP3A4CYP2C9SMN1; SMN2RECQL
SCHEMBL9755887 0.86 POLB (0.51) POLBCYP3A4CYP2C9SMN1; SMN2ABCB1
SCHEMBL9755944 0.85 ABCB1 (0.67) POLBCYP3A4CYP2C9ABCB1
SCHEMBL9756373 0.84 CYP3A4 (0.56) POLBCYP3A4CYP2C9RECQLABCB1
Rh-5849 SCHEMBL1538531 0.83 POLB (1.00) POLBCYP3A4CYP2C9SMN1; SMN2ABCB1

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-0232075-B1 INSECTICIDAL N'-SUBSTITUTED-N-ALKYLCARBONYL-N'-ACYL HYDRAZINES ROHM AND HAAS COMPANY (US) 1991-03-13 EP disclosed
EP-0232075-A1 Insecticidal N'-substituted-N-alkylcarbonyl-N'-acyl hydrazines ROHM AND HAAS COMPANY (US) 1987-08-12 EP disclosed