SCHEMBL9714255

SCHEMBL9714255

Cc1ccc(Cl)c(C(=O)NN(C(=O)c2ccccc2)C(C)(C)C)c1

nearest known ligand 0.69

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ABCB1 P08183 5/20 0.69
POLB P06746 1/20 0.62
CYP3A4 P08684 2/20 0.58
CYP2C9 P11712 2/20 0.58
MEN1 O00255 1/20 0.57
LMNA P02545 1/20 0.57
CYP1A2 P05177 1/20 0.57
CYP2D6 P10635 1/20 0.57
MAPT P10636 1/20 0.57
CYP2C19 P33261 1/20 0.57
HTT P42858 1/20 0.57
KMT2A Q03164 1/20 0.57
NPSR1 Q6W5P4 1/20 0.57

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
SCHEMBL9714259 0.90 ABCB1 (0.69) ABCB1POLBCYP3A4CYP2C9
SCHEMBL9714085 0.85 POLB (0.70) ABCB1POLB
SCHEMBL9714314 0.85 ABCB1 (0.68) ABCB1
SCHEMBL9714147 0.84 ABCB1 (0.67) ABCB1CYP3A4CYP2C9
SCHEMBL9815793 0.82 ABCB1 (0.62) ABCB1
SCHEMBL9714095 0.81 POLB (0.56) ABCB1POLBCYP3A4CYP2C9
SCHEMBL9714124 0.81 ABCB1 (0.64) ABCB1POLBCYP3A4CYP2C9MEN1
SCHEMBL17624858 0.81 ABCB1 (0.77) ABCB1
SCHEMBL9714484 0.81 POLB (0.63) ABCB1POLBCYP3A4CYP2C9
SCHEMBL9241810 0.81 POLB (0.71) ABCB1POLBCYP3A4CYP2C9MEN1

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
EP-0245950-B1 INSECTICIDAL N-SUBSTITUTED-N' - SUBSTITUTED-N, N'-DIACYLHYDRAZINES ROHM AND HAAS COMPANY (US) 1992-06-17 EP disclosed
EP-0236618-B1 INSECTICIDAL N'-SUBSTITUTED-N,N'-DIACYLHYDRAZINES ROHM AND HAAS COMPANY (US) 1991-02-27 EP disclosed