SCHEMBL15925834

SCHEMBL15925834

CN(CC1CCC(CN=C=O)CC1)C(=O)N(CC1CCC(CN=C=O)CC1)C(=O)NCC1CCC(CNC=O)CC1

nearest known ligand 0.32

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ ADH1B P00325 1/20 0.32
▸ ADH1C P00326 1/20 0.32
▸ ADH1A P07327 1/20 0.32
▸ ADH4 P08319 1/20 0.32
▸ ADH7 P40394 1/20 0.32

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
SCHEMBL12161341 0.82 TDP1 (0.37) —
SCHEMBL15623965 0.77 ADH1B (0.52) ADH1BADH1CADH1AADH4ADH7
SCHEMBL18231655 0.74 TDP1 (0.33) —
SCHEMBL17970392 0.65 ADH1B (0.52) ADH1BADH1CADH1AADH4ADH7
SCHEMBL7417936 0.62 KMT2A (0.45) —
SCHEMBL19732912 0.61 ALDH1A1 (0.31) —
SCHEMBL44332 0.61 ALDH1A1 (0.31) —
SCHEMBL207500 0.61 — —
SCHEMBL1590056 0.61 — —
SCHEMBL1081546 0.61 ALDH1A1 (0.31) —

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-2762312-A1 METHOD FOR PRODUCING LITHOGRAPHIC PRINTING PLATE FUJIFILM Corporation (JP) 2014-08-06 — — EP disclosed
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