SCHEMBL11245162

SCHEMBL11245162

Cc1ccc(C2(CCn3ccnc3)OCC(C)O2)cc1

nearest known ligand 0.47

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
HMOX1 P09601 2/20 0.47
QPCT Q16769 2/20 0.41
CYP19A1 P11511 1/20 0.41
CYP11B1 P15538 1/20 0.41
CYP11B2 P19099 1/20 0.41
HSP90AA1 P07900 1/20 0.40
NPSR1 Q6W5P4 1/20 0.40
POLB P06746 1/20 0.39
CTDSP1 Q9GZU7 1/20 0.39
TDP1 Q9NUW8 1/20 0.39
ALDH1A1 P00352 2/20 0.37
KDM4E B2RXH2 1/20 0.37
PRKCI P41743 1/20 0.36
KMT2A Q03164 1/20 0.36

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
SCHEMBL11247263 0.93 QPCT (0.45) HMOX1QPCTCYP19A1CYP11B1CYP11B2
SCHEMBL11238488 0.92 HMOX1 (0.44) HMOX1QPCTCYP19A1CYP11B1CYP11B2
SCHEMBL11243032 0.91 HMOX1 (0.57) HMOX1KDM4E
SCHEMBL11235557 0.89 HMOX1 (0.47) HMOX1CYP19A1CYP11B1CYP11B2
SCHEMBL11233835 0.88 KMT2A (0.45) HMOX1CYP11B1CYP11B2NPSR1POLB
SCHEMBL11246401 0.88 MEN1 (0.46) HMOX1QPCTALDH1A1KDM4EKMT2A
SCHEMBL10851586 0.85 HMOX1 (0.48) HMOX1QPCTCYP19A1CYP11B1CYP11B2
SCHEMBL11236215 0.85 HMOX1 (0.42) HMOX1CYP19A1CYP11B1CYP11B2NPSR1
SCHEMBL11235683 0.84 HMOX1 (0.55) HMOX1QPCTALDH1A1
SCHEMBL11241448 0.84 QPCT (0.46) QPCTCYP19A1CYP11B1CYP11B2POLB

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