SCHEMBL18709162

SCHEMBL18709162

O=C=NC1CCCCC(N=C=O)CCCC1

nearest known ligand 0.94

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.94
EPHX1 P07099 1/20 0.55
HIF1A Q16665 1/20 0.55
APLNR P35414 1/20 0.36
CYP3A4 P08684 1/20 0.35

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
SCHEMBL6196 1.00
SCHEMBL13194400 0.97 ALDH1A1 (0.89) ALDH1A1EPHX1HIF1AAPLNRCYP3A4
SCHEMBL12338087 0.97 ALDH1A1 (1.00) ALDH1A1EPHX1HIF1AAPLNRCYP3A4
SCHEMBL3891086 0.97 ALDH1A1 (0.89) ALDH1A1EPHX1HIF1AAPLNRCYP3A4
SCHEMBL1164134 0.97 ALDH1A1 (1.00) ALDH1A1EPHX1HIF1AAPLNRCYP3A4
SCHEMBL19645458 0.97 ALDH1A1 (1.00) ALDH1A1EPHX1HIF1AAPLNRCYP3A4
SCHEMBL8620 0.97
SCHEMBL12513617 0.97 ALDH1A1 (1.00) ALDH1A1EPHX1HIF1AAPLNRCYP3A4
SCHEMBL15492354 0.97 ALDH1A1 (1.00) ALDH1A1EPHX1HIF1AAPLNRCYP3A4
SCHEMBL13174777 0.97 ALDH1A1 (1.00) ALDH1A1EPHX1HIF1AAPLNRCYP3A4

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
US-9610547-B2 Composite perfluorohydrocarbon membranes, their preparation and use POROGEN CORPORATION (US) 2017-04-04 US disclosed