SCHEMBL31339866

SCHEMBL31339866

N#Cc1cc2ccc(C(F)(F)F)cc2n(-c2ccccc2)c1=O

nearest known ligand 0.52

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ TDP2 O95551 4/20 0.52
▸ CTSK P43235 4/20 0.47
▸ MAT2A P31153 1/20 0.46
▸ G6PD P11413 1/20 0.40
▸ TLR9 Q9NR96 1/20 0.40
▸ PLA2G10 O15496 1/20 0.40
▸ PLA2G2A P14555 1/20 0.40
▸ PLA2G5 P39877 1/20 0.40
▸ TAS2R14 Q9NYV8 1/20 0.39
▸ KDM4E B2RXH2 1/20 0.38
▸ ALDH1A1 P00352 1/20 0.38
▸ GAA P10253 1/20 0.38
▸ AR P10275 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
SCHEMBL31339968 0.80 ALDH1A1 (0.47) TDP2MAT2AKDM4EALDH1A1GAA
SCHEMBL31339816 0.80 TDP2 (0.51) TDP2MAT2AKDM4EALDH1A1GAA
SCHEMBL29417510 0.76 ALDH1A1 (0.42) CTSKMAT2AKDM4EALDH1A1GAA
SCHEMBL24714557 0.75 KDM4E (0.44) TDP2MAT2AKDM4EALDH1A1GAA
SCHEMBL28978826 0.74 MAT2A (0.48) TDP2CTSKMAT2AG6PDTLR9
SCHEMBL29417542 0.74 MAT2A (0.48) TDP2CTSKMAT2AG6PDTLR9
SCHEMBL28978808 0.74 MAT2A (0.48) TDP2CTSKMAT2AG6PDTLR9
SCHEMBL30608124 0.74 MAT2A (0.48) TDP2CTSKMAT2AG6PDTLR9
SCHEMBL30358964 0.74 MAT2A (0.48) TDP2CTSKMAT2AG6PDTLR9
SCHEMBL26125895 0.74 MAT2A (0.48) TDP2CTSKMAT2AG6PDTLR9

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-4501912-A1 NOVEL HETEROCYCLIC COMPOUND Shouyao Holdings (Beijing) Co., Ltd. (CN) 2025-02-05 — — EP disclosed
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