SCHEMBL23340100

SCHEMBL23340100

C=Cc1c[nH]nc1-c1cc(Cl)cc(Cl)c1

nearest known ligand 0.31

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
ALDH1A1 P00352 1/20 0.30
GFER P55789 1/20 0.30
RXFP1 Q9HBX9 1/20 0.30

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
SCHEMBL425389 0.75 TSHR (0.35) ALDH1A1GFERRXFP1
SCHEMBL8431291 0.73 PDGFRB (0.38) ALDH1A1
SCHEMBL8427413 0.72 MAPK13 (0.33) ALDH1A1GFERRXFP1
SCHEMBL8427320 0.68 ADORA2A (0.32) RAB9AALDH1A1GFERRXFP1
SCHEMBL8429433 0.68 TRPM8 (0.34) ALDH1A1GFERRXFP1
SCHEMBL1656405 0.68
SCHEMBL17338475 0.67 XDH (0.40)
SCHEMBL23294328 0.67 KMO (0.42) SMN1; SMN2ALDH1A1
SCHEMBL16945869 0.66 NOTUM (0.40)
SCHEMBL8755909 0.64 MAP4K4 (0.34)

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
WO-2021086874-A1 HETEROCYCLIC CARBOXYLATE COMPOUNDS AS GLYCOLATE OXIDASE INHIBITORS GyanRx Sciences, Inc. (US) 2021-05-06 WO disclosed