SCHEMBL10910652

SCHEMBL10910652

CCCCCCCCCCCCCCCCCNC(=O)OCC(CO)OC

nearest known ligand 0.71

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
EPHX1 P07099 1/20 0.57
ACHE P22303 3/20 0.50

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
SCHEMBL10910045 1.00 EPHX1 (0.57) EPHX1ACHE
SCHEMBL10899266 1.00 EPHX1 (0.57) EPHX1ACHE
SCHEMBL9575983 1.00 EPHX1 (0.57) EPHX1ACHE
SCHEMBL10900276 1.00 EPHX1 (0.57) EPHX1ACHE
SCHEMBL9693941 1.00 EPHX1 (0.57) EPHX1ACHE
SCHEMBL10906661 1.00 EPHX1 (0.57) EPHX1ACHE
SCHEMBL9863527 1.00 EPHX1 (0.57) EPHX1ACHE
SCHEMBL9575985 1.00 EPHX1 (0.57) EPHX1ACHE
SCHEMBL9694130 1.00 EPHX1 (0.57) EPHX1ACHE
SCHEMBL9863810 0.90 EPHX1 (0.56) EPHX1ACHE

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-4582824-A TREATMENT OF VARIOUS CIRCULATORY AND ALLERGIC DISEASES TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1986-04-15 US disclosed