SCHEMBL9495409

SCHEMBL9495409

CC(C)(C)N(NC(=O)c1ccc(Cl)c(Cl)c1)C(=O)c1ccc([N+](=O)[O-])cc1

nearest known ligand 0.60

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ABCB1 P08183 3/20 0.60
CYP3A4 P08684 3/20 0.49
CYP2C9 P11712 3/20 0.49
LMNA P02545 2/20 0.49
CYP1A2 P05177 2/20 0.49
CYP2D6 P10635 2/20 0.49
MAPT P10636 2/20 0.49
CYP2C19 P33261 2/20 0.49
HTT P42858 2/20 0.49
NPSR1 Q6W5P4 2/20 0.49
MEN1 O00255 1/20 0.49
KMT2A Q03164 1/20 0.49
POLB P06746 1/20 0.49
HPGD P15428 1/20 0.48
SMN1; SMN2 Q16637 1/20 0.48
GPR55 Q9Y2T6 1/20 0.46

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
SCHEMBL9714538 0.87 POLB (0.63) ABCB1CYP3A4CYP2C9MEN1KMT2A
SCHEMBL9714257 0.86 CYP3A4 (0.60) ABCB1CYP3A4CYP2C9LMNACYP1A2
SCHEMBL9714318 0.85 POLB (0.56) ABCB1CYP3A4CYP2C9LMNACYP1A2
SCHEMBL9241810 0.84 POLB (0.71) ABCB1CYP3A4CYP2C9LMNACYP1A2
SCHEMBL9714239 0.84 ABCB1 (0.56) ABCB1CYP3A4CYP2C9LMNACYP1A2
SCHEMBL8166763 0.83 POLB (0.74) ABCB1CYP3A4CYP2C9MEN1KMT2A
SCHEMBL9652010 0.83 POLB (0.74) ABCB1CYP3A4CYP2C9MEN1KMT2A
SCHEMBL10752824 0.82 ABCB1 (0.68) ABCB1
SCHEMBL9714400 0.82 ABCB1 (0.64) ABCB1
SCHEMBL9824817 0.81 ABCB1 (0.58) ABCB1CYP3A4CYP2C9LMNACYP1A2

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
US-5237099-A Insecticidal substituted and unsubstituted benzoic acid 1-alkyl, 2-alkyl and 2-cycloalkylhydrazides AMERICAN CYANAMID COMPANY (US) 1993-08-17 US disclosed
US-4814349-A Insecticidal substituted and unsubstituted benzoic acid 1-alkyl, 2 alkyl and 2-cycloalkylhydrazides AMERICAN CYANAMID COMPANY (US) 1989-03-21 US disclosed