SCHEMBL17574580

SCHEMBL17574580

N#Cc1cc([CH]CC(N)=O)ccc1C(F)(F)F

nearest known ligand 0.41

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
RXRA P19793 1/20 0.41
RXRB P28702 1/20 0.41
RXRG P48443 1/20 0.41
AR P10275 9/20 0.41
SCN9A Q15858 6/20 0.37
SLC22A12 Q96S37 1/20 0.37
P4HB P07237 1/20 0.36

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
SCHEMBL15157223 0.81 PTP4A3 (0.41) ARP4HB
SCHEMBL15157445 0.80 KIF11 (0.50)
SCHEMBL3890018 0.79 P4HB (0.44) RXRARXRBRXRGARSCN9A
SCHEMBL6029975 0.79 P4HB (0.44) RXRARXRBRXRGARSCN9A
SCHEMBL16682648 0.79 KIF11 (0.47) ARSLC22A12
SCHEMBL31173121 0.79 KIF11 (0.47) ARSLC22A12
SCHEMBL15157679 0.78 NPFFR1 (0.40)
SCHEMBL12497484 0.78 CYP11B2 (0.43)
SCHEMBL13358948 0.77 NR3C2 (0.40) AR
SCHEMBL15157365 0.75 NPFFR2 (0.54)

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
EP-2809669-B1 FUSED PYRROLEDICARBOXAMIDES AND THEIR USE AS PHARMACEUTICALS SANOFI SA (FR) 2017-02-01 EP disclosed
US-9284333-B2 Fused pyrroledicarboxamides and their use as pharmaceuticals SANOFI (FR) 2016-03-15 US disclosed