SCHEMBL16632550

SCHEMBL16632550

O=S(=O)(Oc1ccc(N(c2ccccc2-c2ccccc2)c2cccc3c2oc2c(C4CCCCC4)cccc23)cc1)C(F)(F)F

nearest known ligand 0.36

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ PTGS2 P35354 1/20 0.36
▸ DRD2 P14416 4/20 0.34
▸ DRD1 P21728 4/20 0.34
▸ DRD4 P21917 4/20 0.34
▸ DRD5 P21918 4/20 0.34
▸ DRD3 P35462 4/20 0.34
▸ PTPN5 P54829 3/20 0.33
▸ PTPN2 P17706 1/20 0.33
▸ HSD11B1 P28845 1/20 0.31
▸ KDM4E B2RXH2 1/20 0.30
▸ ALDH1A1 P00352 1/20 0.30
▸ MAPT P10636 1/20 0.30
▸ HPGD P15428 1/20 0.30
▸ HTT P42858 1/20 0.30
▸ KMT2A Q03164 1/20 0.30
▸ L3MBTL1 Q9Y468 1/20 0.30
▸ PPARG P37231 2/20 0.30
▸ PPARA Q07869 2/20 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
SCHEMBL16632670 0.86 MERTK (0.33) PTGS2MAPTPPARGPPARA
SCHEMBL16633013 0.82 PTPN5 (0.33) PTGS2PTPN5PTPN2
SCHEMBL16641967 0.82 PTGS2 (0.34) PTGS2
SCHEMBL16632993 0.82 CDC14B (0.36) —
SCHEMBL16632652 0.78 CA1 (0.38) PTGS2DRD2DRD1DRD4DRD5
SCHEMBL15852228 0.77 PTGS2 (0.33) PTGS2PTPN5PTPN2ALDH1A1HPGD
SCHEMBL14295542 0.76 CEL (0.33) PTGS2L3MBTL1
SCHEMBL15852238 0.76 PDK2 (0.32) PTGS2PTPN5PTPN2ALDH1A1HPGD
SCHEMBL15696176 0.75 — —
SCHEMBL16641954 0.75 CAMKK1 (0.31) —

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 6 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-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-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
US-20150102321-A1 ORGANIC ELECTROLUMINESCENT MATERIALS AND DEVICES UNIVERSAL DISPLAY CORPORATION 2015-04-16 — — US disclosed
US-20150102321-A1 ORGANIC ELECTROLUMINESCENT MATERIALS AND DEVICES UNIVERSAL DISPLAY CORPORATION 2015-04-16 — — US disclosed
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