SCHEMBL16641967

SCHEMBL16641967

Cc1ccc(N(c2ccccc2-c2ccccc2)c2cccc3c2oc2c(C4CCCCC4)cccc23)cc1

nearest known ligand 0.34

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ PTGS2 P35354 1/20 0.34
▸ PDK2 Q15119 1/20 0.32
▸ PDK4 Q16654 1/20 0.32
▸ PSMB8 P28062 1/20 0.31
▸ PSMB5 P28074 1/20 0.31
▸ CHRM2 P08172 1/20 0.30
▸ CHRM4 P08173 1/20 0.30
▸ CHRM5 P08912 1/20 0.30
▸ CHRM1 P11229 1/20 0.30
▸ CHRM3 P20309 1/20 0.30

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
SCHEMBL16633013 0.90 PTPN5 (0.33) PTGS2
SCHEMBL16632670 0.89 MERTK (0.33) PTGS2
SCHEMBL21906628 0.88 CAMKK2 (0.31) —
SCHEMBL15852229 0.85 CYP1B1 (0.32) PSMB5
SCHEMBL15852237 0.84 PDK2 (0.30) PDK2PDK4
SCHEMBL20909138 0.84 PTGS2 (0.32) PTGS2
SCHEMBL15852228 0.83 PTGS2 (0.33) PTGS2PDK2PDK4
SCHEMBL15852349 0.83 — —
SCHEMBL15852342 0.83 — —
SCHEMBL14295542 0.82 CEL (0.33) PTGS2

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
US-9293712-B2 Disubstituted pyrene compounds with amino group containing ortho aryl group and devices containing the same UNIVERSAL DISPLAY CORPORATION (US) 2016-03-22 — — US disclosed
US-20150102321-A1 ORGANIC ELECTROLUMINESCENT MATERIALS AND DEVICES UNIVERSAL DISPLAY CORPORATION 2015-04-16 — — US disclosed
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