SCHEMBL8425518

SCHEMBL8425518

Cc1cn(-c2ccc(F)c(C(F)(F)F)c2)c(=NC(=O)C(F)C(F)(F)F)s1

nearest known ligand 0.36

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
AR P10275 12/20 0.36
NOTUM Q6P988 1/20 0.35
USP2 O75604 1/20 0.34
POLB P06746 1/20 0.34
ACACB O00763 2/20 0.33
RXRA P19793 2/20 0.33
GRIN1 Q05586 2/20 0.33
GRIN2B Q13224 2/20 0.33
LMNA P02545 1/20 0.32
TP53 P04637 1/20 0.32
MAPT P10636 1/20 0.32
CFTR P13569 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
SCHEMBL8424212 0.92 AR (0.37) ARNOTUMUSP2POLBACACB
SCHEMBL9085276 0.91 AR (0.36) ARNOTUMUSP2POLBACACB
SCHEMBL8424637 0.90 AR (0.36) ARNOTUMUSP2POLBACACB
SCHEMBL9255699 0.86 AR (0.39) ARNOTUMACACBRXRAGRIN1
SCHEMBL9253747 0.85 AR (0.38) ARNOTUMACACBRXRAGRIN1
SCHEMBL8424639 0.82 GABRA2 (0.34) NOTUMTP53MAPT
SCHEMBL8428041 0.82 USP2 (0.33) USP2POLB
SCHEMBL8425725 0.81 CNR2 (0.43) NOTUMPOLB
SCHEMBL8428131 0.78 NPC1 (0.40) RXRAGRIN1GRIN2BLMNAMAPT
SCHEMBL8427939 0.77 CNR1 (0.38) NOTUMACACBRXRAGRIN1GRIN2B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0636616-B1 Process for production of fluoroalkanecarboxamide derivatives SUMITOMO CHEMICAL CO (JP) 1999-10-27 EP disclosed
US-5484933-A Process for production of fluoroalkane carboxamide derivatives SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1996-01-16 US disclosed
EP-0636616-A1 Process for production of fluoroalkanecarboxamide derivatives SUMITOMO CHEMICAL COMPANY LIMITED (JP) 1995-02-01 EP disclosed