SCHEMBL11565667

SCHEMBL11565667

CC1(C(=O)Nc2ccc(OCc3ccccc3F)cc2)CC1C(F)(F)F

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAOB P27338 5/20 0.48
FNTA P49354 1/20 0.48
FNTB P49356 1/20 0.48
MEN1 O00255 2/20 0.46
KMT2A Q03164 2/20 0.46
KDM4E B2RXH2 1/20 0.46
MAPT P10636 1/20 0.46
PARP15 Q460N3 1/20 0.46
PARP14 Q460N5 1/20 0.46
PARP10 Q53GL7 1/20 0.46
SCN9A Q15858 2/20 0.45
SCN3A Q9NY46 7/20 0.45
KCNH2 Q12809 6/20 0.45
SCN1A P35498 1/20 0.42
SCN4A P35499 1/20 0.42
SCN7A Q01118 1/20 0.42
SCN5A Q14524 1/20 0.42
SCN2A Q99250 1/20 0.42
SCN8A Q9UQD0 1/20 0.42
SCN10A Q9Y5Y9 1/20 0.42

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
SCHEMBL11561949 0.86 RAB9A (0.54)
SCHEMBL11568140 0.81 MAOA (0.46) MAOBFNTAFNTBMEN1KMT2A
SCHEMBL11565894 0.79 CNR2 (0.44) FNTAFNTBPARP15PARP10SCN9A
SCHEMBL11565229 0.79 MAPT (0.46) MEN1KMT2AMAPTCYP1A2CYP2C19
SCHEMBL11566816 0.78 CNR2 (0.43) MEN1KMT2AMAPTMMP1ADAM17
SCHEMBL11564075 0.75 GLA (0.49) MEN1KMT2AKDM4EMAPT
SCHEMBL11560701 0.74 ALDH1A1 (0.44) FNTAFNTBMEN1KMT2AKDM4E
SCHEMBL2942771 0.73 MAOB (0.56) MAOBFNTAFNTBMEN1KMT2A
SCHEMBL11441038 0.72 ALDH1A1 (0.40) MEN1KMT2AKDM4EMAPTCYP1A2
SCHEMBL11560520 0.72 CNR2 (0.36) MEN1KMT2AKDM4EMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4166735-A Cycloalkanecarboxanilide derivative herbicides SHELL OIL COMPANY (US) 1979-09-04 US disclosed