SCHEMBL9714110

SCHEMBL9714110

Cc1ccc(C(=O)N(NC(=O)c2ccc(Cl)cc2Cl)C(C)(C)C)cc1

nearest known ligand 0.65

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ABCB1 P08183 4/20 0.56
HTT P42858 2/20 0.52
KDM4E B2RXH2 1/20 0.52
LMNA P02545 1/20 0.52
MAPT P10636 1/20 0.52
CRHBP P24387 1/20 0.52
KMT2A Q03164 1/20 0.52
CRHR2 Q13324 1/20 0.52
TDP1 Q9NUW8 1/20 0.52
FLT1 P17948 1/20 0.50
FLT4 P35916 1/20 0.50
KDR P35968 1/20 0.50
CYP3A4 P08684 1/20 0.49
CYP2C9 P11712 1/20 0.49
CYP2C19 P33261 1/20 0.49

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
SCHEMBL9714145 0.94 ABCB1 (0.60) ABCB1HTTCYP3A4CYP2C9CYP2C19
SCHEMBL9714114 0.90 ABCB1 (0.60) ABCB1
Hydrochloric Acid SCHEMBL8174943 0.89 ABCB1 (0.59) ABCB1
SCHEMBL9714124 0.89 ABCB1 (0.64) ABCB1HTTLMNAMAPTKMT2A
SCHEMBL9714566 0.87 ABCB1 (0.53) ABCB1
SCHEMBL10721343 0.87 ABCB1 (0.53) ABCB1
SCHEMBL10722563 0.87 ABCB1 (0.71) ABCB1
SCHEMBL10720073 0.85 ABCB1 (0.67) ABCB1CYP3A4CYP2C9
SCHEMBL9714314 0.85 ABCB1 (0.68) ABCB1
SCHEMBL9714093 0.84 POLB (0.63) ABCB1HTTCYP3A4CYP2C9CYP2C19

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