SCHEMBL14759307

SCHEMBL14759307

CCCN(CCC)C(=O)C(C)COC1CCCCC1

nearest known ligand 0.38

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ NAAA Q02083 2/20 0.36
▸ EPHX1 P07099 1/20 0.35
▸ ADH1A P07327 2/20 0.33
▸ KDM4E B2RXH2 3/20 0.32
▸ CTDSP1 Q9GZU7 1/20 0.32
▸ ALDH1A1 P00352 2/20 0.31
▸ APOBEC3A P31941 1/20 0.31
▸ APOBEC3G Q9HC16 1/20 0.31
▸ CA12 O43570 1/20 0.31
▸ CA2 P00918 1/20 0.31
▸ CA9 Q16790 1/20 0.31
▸ ADH1C P00326 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
SCHEMBL14759091 0.98 NAAA (0.34) NAAAEPHX1ADH1AKDM4ECTDSP1
SCHEMBL14759118 0.88 EPHX1 (0.37) NAAAEPHX1KDM4EALDH1A1
SCHEMBL14759119 0.86 EPHX1 (0.34) NAAAEPHX1KDM4EALDH1A1
SCHEMBL14759131 0.81 EPHX1 (0.35) NAAAEPHX1KDM4EALDH1A1
SCHEMBL14759200 0.79 EPHX1 (0.33) NAAAEPHX1KDM4E
SCHEMBL14759066 0.74 NAAA (0.39) NAAAEPHX1ADH1AALDH1A1CA12
SCHEMBL27993530 0.73 ALDH1A1 (0.35) NAAAEPHX1KDM4EALDH1A1
SCHEMBL14759424 0.73 CA12 (0.39) ALDH1A1CA12CA2CA9
SCHEMBL16467167 0.72 CYP19A1 (0.45) NAAAEPHX1KDM4EALDH1A1
SCHEMBL14759186 0.72 ALDH1A1 (0.39) NAAAEPHX1ADH1AALDH1A1CA12

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2568019-B1 Inkjet ink JNC CORP (JP) 2015-09-02 — — EP disclosed
EP-2568019-A1 Inkjet ink JNC Corporation (JP) 2013-03-13 — — EP disclosed
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