SCHEMBL27563128

SCHEMBL27563128

NC(=O)c1cccc2c1c1[c]c(F)ccc1n2Cc1ccc(F)cc1

nearest known ligand 0.41

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ PLA2G2A P14555 1/20 0.41
▸ ALDH1A1 P00352 2/20 0.38
▸ SMN1; SMN2 Q16637 2/20 0.38
▸ MAPT P10636 1/20 0.38
▸ HTT P42858 1/20 0.38
▸ POLB P06746 2/20 0.38
▸ CNR2 P34972 1/20 0.38
▸ MEN1 O00255 1/20 0.37
▸ KMT2A Q03164 1/20 0.37
▸ FABP4 P15090 2/20 0.36
▸ MAPK8 P45983 1/20 0.36
▸ L3MBTL1 Q9Y468 1/20 0.36
▸ SCN9A Q15858 1/20 0.36
▸ DRD2 P14416 1/20 0.35
▸ HTR6 P50406 1/20 0.35
▸ TP53 P04637 1/20 0.35
▸ CYP3A4 P08684 1/20 0.35
▸ ABCC1 P33527 1/20 0.35
▸ KDM4E B2RXH2 1/20 0.35

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
SCHEMBL27563188 0.92 PLA2G2A (0.41) PLA2G2AHTT
SCHEMBL27530210 0.90 GPR52 (0.38) PLA2G2APOLBMAPK8L3MBTL1SCN9A
SCHEMBL27530259 0.89 IDO1 (0.40) ALDH1A1SMN1; SMN2HTTPOLBFABP4
SCHEMBL27505260 0.88 MAPK8 (0.38) SMN1; SMN2MAPTHTTPOLBMAPK8
SCHEMBL27507171 0.88 ABCC1 (0.42) PLA2G2AMAPK8L3MBTL1CYP3A4ABCC1
SCHEMBL27525956 0.87 PLA2G1B (0.47) PLA2G2AALDH1A1SMN1; SMN2MAPTHTT
SCHEMBL27505576 0.87 GPR52 (0.39) HTTL3MBTL1CYP3A4ABCC1
SCHEMBL27530677 0.87 PLA2G10 (0.42) FABP4L3MBTL1
SCHEMBL27530143 0.86 PLA2G2A (0.42) PLA2G2AALDH1A1SMN1; SMN2MAPTHTT
SCHEMBL27530159 0.86 PARP15 (0.41) POLBMAPK8L3MBTL1KDM4E

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
CN-1240210-A Substituted tricyclic compound LILLY CO ELI (US) 2000-01-05 — — CN disclosed
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