SCHEMBL9755980

SCHEMBL9755980

CCCCCCC(=O)NN(C(=O)c1ccccc1)C(C)(C)C

nearest known ligand 0.70

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.58
SMN1; SMN2 Q16637 1/20 0.52
CYP3A4 P08684 1/20 0.51
CYP2C9 P11712 1/20 0.51
EPHX2 P34913 1/20 0.49
CES2 O00748 1/20 0.49
CES1 P23141 1/20 0.49
RECQL P46063 1/20 0.48

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
SCHEMBL9755845 1.00 POLB (0.58) POLBSMN1; SMN2CYP3A4CYP2C9EPHX2
SCHEMBL9756190 1.00 POLB (0.58) POLBSMN1; SMN2CYP3A4CYP2C9EPHX2
SCHEMBL9755895 1.00 POLB (0.58) POLBSMN1; SMN2CYP3A4CYP2C9EPHX2
SCHEMBL9755993 1.00 POLB (0.58) POLBSMN1; SMN2CYP3A4CYP2C9EPHX2
SCHEMBL9755922 0.99 POLB (0.60) POLBSMN1; SMN2CYP3A4CYP2C9CES2
SCHEMBL8170061 0.94 POLB (0.61) POLBSMN1; SMN2CYP3A4CYP2C9RECQL
SCHEMBL9756280 0.89 POLB (0.65) POLBSMN1; SMN2CYP3A4CYP2C9RECQL
SCHEMBL9755848 0.87 ALDH1A1 (0.51) POLBSMN1; SMN2CYP3A4CYP2C9
SCHEMBL9756121 0.87 ALDH1A1 (0.51) POLBSMN1; SMN2CYP3A4CYP2C9
SCHEMBL9756343 0.87 ALDH1A1 (0.51) POLBSMN1; SMN2CYP3A4CYP2C9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0234944-B1 INSECTICIDAL N'-SUBSTITUTED-N-ACYL-N'-ALKYLCARBONYLHYDRAZINES ROHM AND HAAS COMPANY (US) 1991-04-10 EP disclosed
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