SCHEMBL9826265

SCHEMBL9826265

CCc1ccccc1C(=O)NN(C(=O)c1ccccc1)C(C)(C)C

nearest known ligand 0.82

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.68
CYP3A4 P08684 1/20 0.59
CYP2C9 P11712 1/20 0.59
SMN1; SMN2 Q16637 2/20 0.58
HPGD P15428 1/20 0.58
ABCB1 P08183 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
SCHEMBL8178777 0.90 POLB (0.67) POLBCYP3A4CYP2C9SMN1; SMN2ABCB1
SCHEMBL9826267 0.90 POLB (0.70) POLBCYP3A4CYP2C9
SCHEMBL10719359 0.89 POLB (0.65) POLBCYP3A4CYP2C9SMN1; SMN2ABCB1
SCHEMBL8172815 0.85 POLB (0.59) POLBCYP3A4CYP2C9SMN1; SMN2HPGD
SCHEMBL9714213 0.83 ABCB1 (0.78) POLBCYP3A4CYP2C9ABCB1
Rh-5849 SCHEMBL1538531 0.82 POLB (1.00) POLBCYP3A4CYP2C9SMN1; SMN2HPGD
SCHEMBL8772414 0.82 POLB (0.70) POLBCYP3A4CYP2C9ABCB1
SCHEMBL9714085 0.82 POLB (0.70) POLBABCB1
SCHEMBL9714356 0.82 POLB (0.70) POLBCYP3A4CYP2C9ABCB1
SCHEMBL9824930 0.82 POLB (0.70) POLBCYP3A4CYP2C9ABCB1

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-0236618-B1 INSECTICIDAL N'-SUBSTITUTED-N,N'-DIACYLHYDRAZINES ROHM AND HAAS COMPANY (US) 1991-02-27 EP disclosed