SCHEMBL11569625

SCHEMBL11569625

CC(C)CCCCCCCCCNC=O

nearest known ligand 0.56

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ ADH1B P00325 6/20 0.56
▸ ADH1A P07327 6/20 0.56
▸ ADH1C P00326 5/20 0.56
▸ ADH7 P40394 4/20 0.56
▸ ADH4 P08319 2/20 0.56
▸ EPHX1 P07099 2/20 0.56
▸ LMNA P02545 1/20 0.40
▸ HIF1A Q16665 3/20 0.37
▸ EPAS1 Q99814 3/20 0.37
▸ KDM4C Q9H3R0 2/20 0.35
▸ KDM4A O75164 1/20 0.35
▸ PHF8 Q9UPP1 1/20 0.35
▸ KDM2A Q9Y2K7 1/20 0.35
▸ GRIA1 P42261 3/20 0.33

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
SCHEMBL14937478 1.00 ADH1B (0.56) ADH1BADH1AADH1CADH7ADH4
SCHEMBL11354637 1.00 ADH1B (0.56) ADH1BADH1AADH1CADH7ADH4
SCHEMBL11153834 1.00 ADH1B (0.56) ADH1BADH1AADH1CADH7ADH4
SCHEMBL11568445 1.00 ADH1B (0.56) ADH1BADH1AADH1CADH7ADH4
SCHEMBL8186479 0.98 ADH1B (0.54) ADH1BADH1AADH1CADH7ADH4
SCHEMBL271073 0.93 — —
SCHEMBL25827892 0.86 ADH1B (0.43) ADH1BADH1AADH1CADH7ADH4
SCHEMBL269241 0.82 — —
SCHEMBL24607335 0.81 ADH1B (0.43) ADH1BADH1AADH1CADH7ADH4
SCHEMBL21401419 0.80 ADH1B (0.68) ADH1BADH1AADH1CADH7ADH4

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-0001798-A1 Process for the preparation of amines from formamides BAYER AG (DE) 1979-05-16 — — EP disclosed
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