SCHEMBL21745876

SCHEMBL21745876

C/C(=N/N)SCC1CCCC1

nearest known ligand 0.33

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
EPHX1 P07099 1/20 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
SCHEMBL7600176 0.73 CYP1A2 (0.41) EPHX1
SCHEMBL5641934 0.70 EPHX1 (0.43) EPHX1
Ammonia Solution, Strong SCHEMBL7435862 0.70 ACE (0.39) EPHX1
SCHEMBL3762817 0.65 EPHX1 (0.43) EPHX1
SCHEMBL20671858 0.64
SCHEMBL11451288 0.64 EPHX1 (0.37) EPHX1
SCHEMBL21276623 0.62
SCHEMBL9755482 0.62
SCHEMBL87296 0.61
SCHEMBL11451289 0.61 EPHX1 (0.35) EPHX1

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-2944637-B1 NITROGEN-CONTAINING HETEROCYLIC COMPOUND OR SALT THEREOF FUJIFILM CORP (JP) 2020-02-19 EP disclosed