SCHEMBL5592277

SCHEMBL5592277

Nc1ccc(O)c(Cn2ccnc2)c1

nearest known ligand 0.57

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CYP11B1 P15538 7/20 0.57
CYP11B2 P19099 6/20 0.57
BRD4 O60885 2/20 0.56
KDM4E B2RXH2 1/20 0.52
LMNA P02545 1/20 0.52
POLB P06746 1/20 0.52
MAPT P10636 1/20 0.52
TDP1 Q9NUW8 1/20 0.52
L3MBTL1 Q9Y468 1/20 0.52
ACHE P22303 3/20 0.50
IDH1 O75874 2/20 0.47
CYP19A1 P11511 3/20 0.47
PRKCI P41743 1/20 0.46
ESR1 P03372 1/20 0.45
ESR2 Q92731 1/20 0.45

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
SCHEMBL5188946 0.85 CYP11B1 (0.46) CYP11B1CYP11B2BRD4TDP1L3MBTL1
SCHEMBL5610972 0.84 CYP11B1 (0.60) CYP11B1CYP11B2BRD4POLBMAPT
SCHEMBL2508169 0.83 BRD4 (0.51) CYP11B1CYP11B2BRD4KDM4ELMNA
SCHEMBL2508166 0.83 BRD4 (0.51) CYP11B1CYP11B2BRD4KDM4ELMNA
SCHEMBL8936715 0.81 CYP11B1 (0.58) CYP11B1CYP11B2BRD4KDM4ELMNA
SCHEMBL10945622 0.81 CYP11B1 (0.57) CYP11B1CYP11B2BRD4KDM4ELMNA
SCHEMBL4290436 0.81 CYP11B1 (0.62) CYP11B1CYP11B2KDM4EPOLBCYP19A1
SCHEMBL2509182 0.79 BRD4 (0.50) CYP11B1CYP11B2BRD4KDM4ELMNA
SCHEMBL2509183 0.79 BRD4 (0.50) CYP11B1CYP11B2BRD4KDM4ELMNA
SCHEMBL30168127 0.78 CYP11B1 (0.62) CYP11B1CYP11B2BRD4KDM4EPOLB

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2007079800-A1 IMIDAZOLYLMETHYL-SUBSTITUTED DEVELOPERS HENKEL KOMMANDITGESELLSCHAFT AUF AKTIEN (DE) 2007-07-19 WO claimed
WO-2007079800-A1 IMIDAZOLYLMETHYL-SUBSTITUTED DEVELOPERS HENKEL KOMMANDITGESELLSCHAFT AUF AKTIEN (DE) 2007-07-19 WO disclosed
WO-2007079800-A1 IMIDAZOLYLMETHYL-SUBSTITUTED DEVELOPERS HENKEL KOMMANDITGESELLSCHAFT AUF AKTIEN (DE) 2007-07-19 WO disclosed