SCHEMBL8038378

SCHEMBL8038378

O=C(Cl)c1ccc(C2(F)CC2c2ccccc2)cc1

nearest known ligand 0.40

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
MAOB P27338 14/20 0.40
MAOA P21397 11/20 0.40
MAPK1 P28482 1/20 0.39
CYP2C19 P33261 1/20 0.39
KDM1A O60341 9/20 0.37
CHRM1 P11229 1/20 0.35
RIPK1 Q13546 1/20 0.34

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
SCHEMBL8036369 0.88 MAOB (0.42) MAOBMAOAMAPK1CYP2C19KDM1A
Hydrochloric Acid SCHEMBL8038381 0.86 MAOB (0.43) MAOBMAOAMAPK1CYP2C19KDM1A
SCHEMBL8034589 0.78 RORC (0.42) KDM1A
SCHEMBL8036360 0.78 ALOX15 (0.50) MAOBMAOAMAPK1KDM1A
SCHEMBL8036366 0.75 MLYCD (0.47) MAPK1CYP2C19
SCHEMBL8040665 0.75 POLB (0.56) MAPK1CYP2C19
SCHEMBL8461900 0.71 TSHR (0.46)
SCHEMBL10981382 0.70 KDM1A (0.53) MAOBMAOAMAPK1CYP2C19KDM1A
SCHEMBL106104 0.68 ALDH1A1 (0.39)
Benzene SCHEMBL10386399 0.67 ALDH1A1 (0.54) MAPK1CYP2C19

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-6159973-A Aromatic amides, their preparation process, the compositions containing them and their use as pesticides HOECHST SCHERING AGREVO S.A. (FR) 2000-12-12 US disclosed
US-6013837-A E.G.,4-(2-(3,4,5-TRICHLORO PHENYL) 1-FLUOROCYCLOPROPYL)-N-(2-METHYL PHENYL)BENZAMIDE; PARTICULAR USE AGAINST ARTHROPODS, HELMINTHS AND MOLLUSCS; INSECTICIDES; ACARICIDES; NEMATICIDES; PHOTOSTABILITY; NONTOXIC TO MAMMALS HOECHST MARION ROUSSEL (FR) 2000-01-11 US disclosed