SCHEMBL11244869

SCHEMBL11244869

CC(C)(C)c1ccc(CC2(Cn3ccnc3)OCCO2)cc1

nearest known ligand 0.55

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
HMOX1 P09601 4/20 0.55
MEN1 O00255 1/20 0.44
POLB P06746 1/20 0.44
KMT2A Q03164 1/20 0.44

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
SCHEMBL11245347 0.95 HMOX1 (0.50) HMOX1MEN1POLBKMT2A
SCHEMBL11244623 0.88 HMOX1 (0.72) HMOX1
SCHEMBL11251782 0.88 KMT2A (0.48) HMOX1MEN1POLBKMT2A
SCHEMBL11245900 0.87 HMOX1 (0.42) HMOX1MEN1POLBKMT2A
SCHEMBL11247376 0.86 HMOX1 (0.58) HMOX1
SCHEMBL11243141 0.85 HMOX1 (0.43) HMOX1MEN1POLBKMT2A
Bromide SCHEMBL11244745 0.85 HMOX1 (0.57) HMOX1
SCHEMBL11235741 0.84 HMOX1 (0.52) HMOX1
SCHEMBL11252474 0.84 HMOX1 (0.62) HMOX1
SCHEMBL11245199 0.83 KMT2A (0.46) HMOX1MEN1POLBKMT2A

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