SCHEMBL11246480

SCHEMBL11246480

CC1COC(CCn2ccnc2)(Cc2ccc(Cl)cc2Cl)O1

nearest known ligand 0.61

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
HMOX1 P09601 2/20 0.61
USP2 O75604 1/20 0.46
ALDH1A1 P00352 1/20 0.46
LMNA P02545 1/20 0.46
ALOX15 P16050 1/20 0.46
TSHR P16473 1/20 0.46
HTT P42858 1/20 0.46
ADRA1A P35348 1/20 0.42

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
SCHEMBL11242956 0.86 HMOX1 (0.70) HMOX1
SCHEMBL11243076 0.86 HMOX1 (0.76) HMOX1
SCHEMBL11245098 0.84 CYP2C9 (0.44) HMOX1LMNAADRA1A
SCHEMBL11240321 0.83 HMOX1 (0.52) HMOX1TSHR
SCHEMBL11252422 0.82 HMOX1 (0.41) HMOX1USP2ALDH1A1LMNAALOX15
SCHEMBL11241392 0.82 CYP2C9 (0.43) HMOX1LMNAADRA1A
SCHEMBL11249464 0.81 HMOX1 (0.82) HMOX1
SCHEMBL11239858 0.81 HMOX1 (0.40) HMOX1USP2ALDH1A1LMNAALOX15
SCHEMBL11242305 0.81 HMOX1 (0.67) HMOX1
SCHEMBL11236268 0.80 KCNH2 (0.40) HMOX1USP2ALDH1A1LMNAALOX15

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