SCHEMBL28875499

SCHEMBL28875499

CN1c2ccc(O)cc2COC1C=O

nearest known ligand 0.42

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
▸ ACHE P22303 1/20 0.41

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
SCHEMBL28755759 0.77 CSF1R (0.32) —
SCHEMBL27606748 0.75 HTR2C (0.32) —
SCHEMBL27859215 0.74 MEN1 (0.34) —
SCHEMBL28311915 0.72 ACHE (0.42) ACHE
SCHEMBL27859623 0.72 ACHE (0.55) ACHE
SCHEMBL27841613 0.71 ESR1 (0.36) —
SCHEMBL28311081 0.66 KDM4E (0.36) ACHE
SCHEMBL27858113 0.66 ACHE (0.48) ACHE
SCHEMBL30293240 0.66 EGFR (0.40) ACHE
SCHEMBL28979216 0.66 EGFR (0.40) ACHE

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-109988093-A The aminated compounds for inhibiting SSAO/VAP-1 and its application in medicine 广东东阳光药业有限公司 2019-07-09 — — CN disclosed
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