SCHEMBL11242016

SCHEMBL11242016

CCCCOc1ccc(CCC2(Cn3ccnc3)OCC(C)(C)CO2)cc1

nearest known ligand 0.54

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
HMOX1 P09601 3/20 0.54

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
SCHEMBL11254179 0.91 HMOX1 (0.53) HMOX1
SCHEMBL11239513 0.91 HMOX1 (0.53) HMOX1
SCHEMBL11238034 0.91 HMOX1 (0.67) HMOX1
SCHEMBL11243335 0.89 HMOX1 (0.61) HMOX1
SCHEMBL11238194 0.87 HMOX1 (0.58) HMOX1
SCHEMBL11238440 0.84 HMOX1 (0.62) HMOX1
SCHEMBL11233797 0.84 KDM4E (0.49)
SCHEMBL11236098 0.83 HMOX1 (0.53) HMOX1
SCHEMBL11239283 0.83 HMOX1 (0.51) HMOX1
SCHEMBL11248777 0.83 HMOX1 (0.73) HMOX1

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-0049565-A2 Derivatives of substituted N-alkylimidazoles, their preparation and pharmaceutical compositions containing them SYNTEX (U.S.A.) INC. (US) 1982-04-14 EP disclosed
US-4321272-A Derivatives of substituted N-alkylimidazoles SYNTEX (U.S.A.) INC. (US) 1982-03-23 US disclosed