SCHEMBL7015218

SCHEMBL7015218

CCOC(=O)C(C)c1ccc(-n2c(CC)nc3cc(C)c(Cl)nc32)cc1

nearest known ligand 0.40

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 4/20 0.39
KMT2A Q03164 4/20 0.39
POLB P06746 1/20 0.39
PABPC1 P11940 1/20 0.39
PSEN1 P49768 1/20 0.36
PSEN2 P49810 1/20 0.36
APH1B Q8WW43 1/20 0.36
NCSTN Q92542 1/20 0.36
APH1A Q96BI3 1/20 0.36
PSENEN Q9NZ42 1/20 0.36
TP53 P04637 3/20 0.35
ESR1 P03372 1/20 0.35
ESR2 Q92731 1/20 0.35
SMN1; SMN2 Q16637 2/20 0.34
MAPK1 P28482 1/20 0.34
PTGS2 P35354 1/20 0.34
BLM P54132 1/20 0.33

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
SCHEMBL6386347 0.92 MEN1 (0.39) MEN1KMT2APOLBPABPC1PSEN1
SCHEMBL7017481 0.89 KMT2A (0.40) MEN1KMT2APOLBPABPC1PSEN1
SCHEMBL7018959 0.84 MEN1 (0.43) MEN1KMT2APOLBPABPC1PSEN1
SCHEMBL7097040 0.82 ESR1 (0.40) MEN1KMT2APOLBPABPC1PSEN1
SCHEMBL28008223 0.82 KMT2A (0.44) MEN1KMT2APOLBPABPC1TP53
SCHEMBL28008635 0.82 MEN1 (0.44) MEN1KMT2APOLBPABPC1PSEN1
SCHEMBL7098251 0.81 SMN1; SMN2 (0.39) MEN1KMT2APOLBPABPC1PSEN1
SCHEMBL7099008 0.81 SMN1; SMN2 (0.40) MEN1KMT2APOLBPABPC1PSEN1
SCHEMBL6426223 0.80 PSEN1 (0.45) MEN1KMT2APSEN1PSEN2APH1B
SCHEMBL7019911 0.80 PDE10A (0.45) MEN1KMT2APOLBPABPC1

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-1326864-A2 ARYL OR HETEROARYL FUSED IMIDAZOLE COMPOUNDS AS ANTI-INFLAMMATORY AND ANALGESIC AGENTS PFIZER PHARMACEUTICALS INC. (JP) 2003-07-16 EP disclosed
WO-2002032900-A2 ARYL OR HETEROARYL FUSED IMIDAZOLE COMPOUNDS AS ANTI-INFLAMMATORY AND ANALGESIC AGENTS PFIZER PHARMACEUTICALS INC. (JP) 2002-04-25 WO disclosed