SCHEMBL11248831

SCHEMBL11248831

Clc1ccc(CCC2(CCn3ccnc3)OCCCO2)cc1

nearest known ligand 0.72

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
HMOX1 P09601 3/20 0.58

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
SCHEMBL11228453 0.95 HMOX1 (0.61) HMOX1
SCHEMBL10250115 0.89 HMOX1 (0.70) HMOX1
SCHEMBL11243047 0.89 CYP2A6 (0.50) HMOX1
SCHEMBL11237925 0.88 HMOX1 (0.56) HMOX1
Hydrochloric Acid SCHEMBL410009 0.88 HMOX1 (0.71) HMOX1
SCHEMBL11235588 0.88 HMOX1 (0.55) HMOX1
SCHEMBL11247099 0.86 HMOX1 (0.59) HMOX1
SCHEMBL11246856 0.85 HMOX1 (0.53) HMOX1
SCHEMBL11243129 0.84 HMOX1 (0.57) HMOX1
SCHEMBL11238051 0.84 CYP2A6 (0.52) 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