SCHEMBL19554208

SCHEMBL19554208

O=C(Nc1ccc(Cl)cc1-c1n[nH]c(=O)o1)c1ccc2cc(F)ccc2c1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NOTUM Q6P988 5/20 0.44
KCNMA1 Q12791 1/20 0.41
CA12 O43570 1/20 0.41
CA1 P00915 1/20 0.41
CA2 P00918 1/20 0.41
CA7 P43166 1/20 0.41
CA9 Q16790 1/20 0.41
ALOX15 P16050 4/20 0.41
TAS1R3 Q7RTX0 1/20 0.39
TAS1R1 Q7RTX1 1/20 0.39
TAS1R2 Q8TE23 1/20 0.39
CCNE2 O96020 2/20 0.39
CCNE1 P24864 2/20 0.39
CDK2 P24941 2/20 0.39
MAPT P10636 1/20 0.39
RXFP1 Q9HBX9 1/20 0.39
LMNA P02545 2/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
HDAC3 O15379 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
SCHEMBL19555065 0.80 GRIK1 (0.43) KCNMA1CA12CA1CA2CA7
SCHEMBL19554168 0.78 KCNMA1 (0.43) KCNMA1ALOX15TAS1R3TAS1R1TAS1R2
SCHEMBL19554229 0.77 SERPINE1 (0.61) CA12CA1CA2CA7CA9
SCHEMBL19554313 0.73 KCNMA1 (0.42) KCNMA1TAS1R3TAS1R1TAS1R2MAPT
SCHEMBL19554946 0.69 F10 (0.51) CA12CA1CA2CA7CA9
SCHEMBL19575738 0.69 TAS1R3 (0.45) KCNMA1CA12CA1CA2CA7
SCHEMBL19575815 0.68 F10 (0.44) KCNMA1CA12CA1CA2CA7
SCHEMBL19554134 0.68 SERPINE1 (0.68) CA12CA1CA2CA7CA9
SCHEMBL19554200 0.68 GPR35 (0.55) F10
SCHEMBL19575737 0.67 KCNMA1 (0.44) KCNMA1TAS1R3TAS1R1TAS1R2MAPT

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
WO-2017192304-A1 ARYLCARBOXAMIDES AND USES THEREOF INCEPTION 1, INC. (US) 2017-11-09 WO claimed
WO-2017192304-A1 ARYLCARBOXAMIDES AND USES THEREOF INCEPTION 1, INC. (US) 2017-11-09 WO disclosed
WO-2017192304-A1 ARYLCARBOXAMIDES AND USES THEREOF INCEPTION 1, INC. (US) 2017-11-09 WO disclosed