SCHEMBL19495463

SCHEMBL19495463

CCn1c(=O)ccc2cc(C(F)(F)F)ccc21

nearest known ligand 0.45

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ MAPK9 P45984 11/20 0.45
▸ MAPK10 P53779 9/20 0.41
▸ MAPK8 P45983 8/20 0.41
▸ PPARG P37231 1/20 0.40
▸ PGR P06401 1/20 0.39
▸ BTK Q06187 1/20 0.39
▸ CCR2 P41597 1/20 0.39
▸ HDAC1 Q13547 1/20 0.38
▸ HDAC8 Q9BY41 1/20 0.38
▸ HDAC6 Q9UBN7 1/20 0.38
▸ MAOB P27338 1/20 0.38

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
SCHEMBL3720591 0.81 MAPK9 (0.53) MAPK9MAPK10MAPK8PPARGCCR2
SCHEMBL29456264 0.81 MAPK9 (0.53) MAPK9MAPK10MAPK8PPARGCCR2
SCHEMBL29456233 0.80 KDM4E (0.48) MAPK9MAPK10MAPK8PPARG
SCHEMBL3780636 0.80 KDM4E (0.48) MAPK9MAPK10MAPK8PPARG
SCHEMBL3782016 0.80 MAPK9 (0.52) MAPK9MAPK10MAPK8CCR2
SCHEMBL29456267 0.80 MAPK9 (0.52) MAPK9MAPK10MAPK8CCR2
SCHEMBL29456293 0.79 MAPK9 (0.52) MAPK9MAPK10MAPK8
SCHEMBL3783019 0.79 MAPK9 (0.52) MAPK9MAPK10MAPK8
Flucarbril SCHEMBL30086956 0.79 BRPF1 (0.57) —
Flucarbril SCHEMBL2109672 0.79 BRPF1 (0.57) —

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
EP-2393806-B1 INHIBITORS OF JUN N-TERMINAL KINASE ELAN PHARM INC (US) 2017-10-25 — — EP disclosed
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