SCHEMBL22912277

SCHEMBL22912277

CNSCCCSc1nc(-c2ccc(=O)n(Cc3ccc(OC)c(OC)c3)c2)cc(C(F)F)n1

nearest known ligand 0.48

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ SDHB P21912 12/20 0.48
▸ MAPT P10636 2/20 0.41
▸ TP53 P04637 1/20 0.41
▸ PDE2A O00408 1/20 0.35
▸ PDE3A Q14432 1/20 0.35
▸ MAPK10 P53779 1/20 0.35
▸ RXFP1 Q9HBX9 1/20 0.33

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
SCHEMBL19805988 0.94 SDHB (0.53) SDHBMAPTTP53PDE2APDE3A
SCHEMBL19806088 0.90 SDHB (0.54) SDHBMAPTTP53PDE2APDE3A
SCHEMBL19805843 0.85 SDHB (0.55) SDHBMAPTTP53PDE2APDE3A
SCHEMBL19805996 0.85 SDHB (0.46) SDHBMAPTTP53PDE2APDE3A
SCHEMBL19805982 0.85 SDHB (0.46) SDHBMAPTTP53PDE2APDE3A
SCHEMBL22912209 0.83 SDHB (0.48) SDHBTP53
SCHEMBL22912212 0.80 SDHB (0.46) SDHBMAPTTP53PDE2APDE3A
SCHEMBL26313143 0.79 SDHB (0.57) SDHBMAPTTP53PDE2APDE3A
SCHEMBL26313164 0.79 SDHB (0.49) SDHBMAPTTP53
SCHEMBL26313146 0.79 SDHB (0.49) SDHBMAPTTP53

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-3484854-B1 APOPTOSIS INHIBITORS NAT INSTITUTE OF BIOLOGICAL SCIENCES BEIJING (CN) 2021-01-20 — — EP disclosed
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