SCHEMBL9714512

SCHEMBL9714512

CCc1ccc(C(=O)NN(C(=O)c2cccc(CC)c2)C(C)(C)C)cc1

nearest known ligand 0.79

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
HPGD P15428 1/20 0.78
SMN1; SMN2 Q16637 1/20 0.78
ABCB1 P08183 3/20 0.71
CYP3A4 P08684 2/20 0.71
CYP2C9 P11712 1/20 0.67
POLB P06746 1/20 0.59

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
SCHEMBL9714506 0.95 HPGD (0.78) HPGDSMN1; SMN2ABCB1CYP3A4CYP2C9
SCHEMBL10720312 0.93 ABCB1 (0.68) HPGDSMN1; SMN2ABCB1CYP3A4CYP2C9
SCHEMBL9824810 0.90 HPGD (0.74) HPGDSMN1; SMN2ABCB1CYP3A4CYP2C9
SCHEMBL8772428 0.90 ABCB1 (0.80) HPGDSMN1; SMN2ABCB1CYP3A4CYP2C9
Hydrochloric Acid SCHEMBL8172965 0.89 HPGD (0.72) HPGDSMN1; SMN2ABCB1CYP3A4CYP2C9
SCHEMBL10721329 0.88 POLB (0.69) HPGDSMN1; SMN2ABCB1CYP3A4CYP2C9
SCHEMBL9714554 0.88 HPGD (0.89) HPGDSMN1; SMN2ABCB1CYP3A4CYP2C9
SCHEMBL8773650 0.88 HPGD (0.89) HPGDSMN1; SMN2ABCB1CYP3A4CYP2C9
SCHEMBL8423072 0.88 HPGD (1.00) HPGDSMN1; SMN2ABCB1CYP3A4CYP2C9
SCHEMBL10718744 0.86 HPGD (0.67) HPGDSMN1; SMN2ABCB1CYP3A4CYP2C9

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-0245950-B1 INSECTICIDAL N-SUBSTITUTED-N' - SUBSTITUTED-N, N'-DIACYLHYDRAZINES ROHM AND HAAS COMPANY (US) 1992-06-17 EP disclosed