SCHEMBL9737747

SCHEMBL9737747

COCc1cc(C(F)(F)F)nc(N(C(N)=O)c2c(C)cccc2Cl)n1

nearest known ligand 0.36

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
PTGES O14684 4/20 0.36
MAPK14 Q16539 2/20 0.36
NPSR1 Q6W5P4 1/20 0.33
GAA P10253 1/20 0.33
PDE4B Q07343 1/20 0.33
RXRA P19793 1/20 0.32
RXRB P28702 1/20 0.32
RXRG P48443 1/20 0.32
PPARD Q03181 1/20 0.32
PPARA Q07869 1/20 0.32
MAOB P27338 1/20 0.32
ESR1 P03372 1/20 0.32
MAPT P10636 1/20 0.32
IGF1R P08069 1/20 0.32

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
SCHEMBL9740354 0.84 MAPK14 (0.39) MAPK14RXRARXRBRXRGPPARD
SCHEMBL9737076 0.79 MAPK14 (0.43) MAPK14NPSR1GAAMAPT
SCHEMBL9739327 0.75 SDHB (0.39) MAPK14GAA
SCHEMBL9738360 0.75 MAPK14 (0.41) MAPK14GAA
SCHEMBL9737104 0.75 LMNA (0.40) MAPK14MAPT
SCHEMBL9738335 0.74 MAPK14 (0.39) MAPK14NPSR1GAAPDE4BMAPT
SCHEMBL10517233 0.74 MAPK14 (0.36) MAPK14ESR1MAPT
SCHEMBL9504996 0.74 CYP1A2 (0.37) GAARXRARXRBRXRGPPARD
SCHEMBL9737369 0.73 MAPK14 (0.40) MAPK14GAAMAPT
SCHEMBL9738579 0.73 PRKD3 (0.43) MAPK14

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-5159078-A Herbicides, plant growth regulator CIBA-GEIGY CORPORATION (US) 1992-10-27 US disclosed
US-4966622-A HERBICIDES, PLANT GROWTH REGULATORS CIBA-GEIGY CORPORATION (US) 1990-10-30 US disclosed