SCHEMBL28387436

SCHEMBL28387436

O=CC1CCNc2c(Cl)cc(F)cc21

nearest known ligand 0.32

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ OPRL1 P41146 3/20 0.32
▸ MEN1 O00255 1/20 0.30
▸ KMT2A Q03164 1/20 0.30
▸ L3MBTL1 Q9Y468 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
SCHEMBL27821224 0.82 — —
SCHEMBL27580035 0.82 — —
SCHEMBL28453747 0.82 F12 (0.43) —
SCHEMBL27576211 0.77 ATM (0.31) —
SCHEMBL23846923 0.76 OPRL1 (0.32) OPRL1
SCHEMBL26503989 0.76 HTR2A (0.36) OPRL1
SCHEMBL28457172 0.75 MAPT (0.41) MEN1KMT2A
SCHEMBL28460793 0.72 F12 (0.40) —
SCHEMBL28384647 0.70 — —
SCHEMBL23846917 0.69 — —

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-109503478-B 2, 3-dihydro-1H-quinoline-4-ketone thiosemicarbazone derivative and preparation method and application thereof 岭南师范学院 2020-04-24 — — CN disclosed
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