SCHEMBL10721968

SCHEMBL10721968

CCCCc1ccc(C(=O)NN(C(=O)c2ccc(Cl)cc2)C(C)(C)C)cc1

nearest known ligand 0.67

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
HPGD P15428 1/20 0.66
SMN1; SMN2 Q16637 1/20 0.66
ABCB1 P08183 2/20 0.62
CYP3A4 P08684 1/20 0.55
POLB P06746 2/20 0.53
KDM4E B2RXH2 1/20 0.52
ALDH1A1 P00352 1/20 0.52
GAA P10253 1/20 0.52
CTDSP1 Q9GZU7 1/20 0.52
PLK1 P53350 1/20 0.51

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
Hydrochloric Acid SCHEMBL8180457 0.99 HPGD (0.64) HPGDSMN1; SMN2ABCB1CYP3A4POLB
SCHEMBL10720191 0.95 HPGD (0.63) HPGDSMN1; SMN2ABCB1CYP3A4POLB
SCHEMBL9714441 0.93 ABCB1 (0.72) HPGDSMN1; SMN2ABCB1CYP3A4POLB
SCHEMBL9714435 0.93 ABCB1 (0.72) HPGDSMN1; SMN2ABCB1CYP3A4POLB
SCHEMBL10719160 0.89 POLB (0.70) HPGDSMN1; SMN2ABCB1CYP3A4POLB
SCHEMBL9876844 0.89 POLB (0.70) HPGDSMN1; SMN2ABCB1CYP3A4POLB
SCHEMBL9714459 0.87 HPGD (0.86) HPGDSMN1; SMN2ABCB1CYP3A4POLB
SCHEMBL9714453 0.87 HPGD (0.86) HPGDSMN1; SMN2ABCB1CYP3A4POLB
SCHEMBL10722162 0.87 ABCB1 (0.55) HPGDSMN1; SMN2ABCB1
Hydrochloric Acid SCHEMBL8174716 0.86 HPGD (0.84) HPGDSMN1; SMN2ABCB1CYP3A4POLB

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-A2 Insecticidal N'-substituted-N,N'-diacylhydrazines ROHM AND HAAS COMPANY (US) 1987-09-16 EP disclosed