SCHEMBL28206105

SCHEMBL28206105

[O]CC1CCN(NC=O)CC1

nearest known ligand 0.30

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ ADH1B P00325 1/20 0.30
▸ ADH1C P00326 1/20 0.30
▸ ADH1A P07327 1/20 0.30
▸ ADH4 P08319 1/20 0.30
▸ ADH7 P40394 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
SCHEMBL27673409 0.81 EPHX2 (0.30) —
SCHEMBL10726540 0.74 — —
SCHEMBL3893979 0.73 GPR119 (0.34) —
SCHEMBL26105401 0.73 CARM1 (0.34) —
SCHEMBL6050116 0.72 — —
SCHEMBL28137263 0.71 ADH1B (0.56) ADH1BADH1CADH1AADH4ADH7
SCHEMBL28206026 0.70 HSD17B10 (0.32) —
SCHEMBL26192 0.68 — —
SCHEMBL1259819 0.68 — —
SCHEMBL4425977 0.66 ADH1B (0.31) ADH1BADH1CADH1AADH4

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-107778287-A A kind of compound as tyrosine protein kinase inhibitor 南昌弘益药业有限公司 2018-03-09 — — CN disclosed
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