SCHEMBL8525187

SCHEMBL8525187

NNC(=O)c1ccc(-c2ccc([N+](=O)[O-])cc2)cc1

nearest known ligand 0.62

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ POLB P06746 2/20 0.57
▸ MAPK1 P28482 2/20 0.57
▸ TSHR P16473 1/20 0.56
▸ MEN1 O00255 2/20 0.56
▸ KMT2A Q03164 2/20 0.56
▸ CA1 P00915 3/20 0.55
▸ CA2 P00918 3/20 0.55
▸ CA12 O43570 1/20 0.55
▸ CA9 Q16790 1/20 0.55
▸ CA14 Q9ULX7 1/20 0.55
▸ CES1 P23141 1/20 0.55
▸ MAPT P10636 3/20 0.54
▸ NPC1 O15118 1/20 0.54
▸ RAB9A P51151 1/20 0.54
▸ TDP1 Q9NUW8 1/20 0.53
▸ ALDH1A1 P00352 1/20 0.52
▸ GSK3B P49841 1/20 0.51
▸ LMNA P02545 1/20 0.51
▸ GAA P10253 1/20 0.51

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
SCHEMBL165760 0.94 TSHR (0.62) POLBMAPK1TSHRMEN1KMT2A
SCHEMBL752600 0.82 MPO (0.70) POLBMEN1KMT2ACA1CA2
SCHEMBL18837900 0.82 MAPT (0.58) POLBMAPK1TSHRMEN1KMT2A
SCHEMBL27856677 0.82 MAPT (0.48) POLBTSHRMEN1KMT2AMAPT
SCHEMBL16367722 0.81 KMT2A (0.76) POLBMAPK1MEN1KMT2AMAPT
SCHEMBL5696165 0.79 TSHR (0.88) POLBMAPK1TSHRCA1CA2
SCHEMBL28723007 0.79 MEN1 (0.82) POLBMAPK1TSHRMEN1KMT2A
SCHEMBL28914440 0.79 MAPK1 (0.85) POLBMAPK1TSHRCA1CA2
SCHEMBL27815181 0.79 MAPT (0.67) POLBMAPK1TSHRMEN1KMT2A
SCHEMBL28446043 0.79 MAPT (0.57) POLBTSHRMEN1KMT2ACA2

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
JP-11329737-A — — None — — JP disclosed
JP-H11329737-A ORGANIC MULTILAYER TYPE ELECTROLUMINESCENT ELEMENT AND SYNTHESIZING METHOD OF STRUCTURE BODY FOR ORGANIC MULTILAYER TYPE ELECTROLUMINESCENT ELEMENT TAIHO IND CO LTD 1999-11-30 — — JP disclosed
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