SCHEMBL7880687

SCHEMBL7880687

Cc1ccc([N+](=O)[O-])c(Nc2cccc(CN)c2)n1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ BRD4 O60885 3/20 0.43
▸ MAPT P10636 4/20 0.41
▸ L3MBTL1 Q9Y468 3/20 0.41
▸ BLM P54132 1/20 0.41
▸ NPSR1 Q6W5P4 1/20 0.41
▸ TDP1 Q9NUW8 1/20 0.41
▸ ALDH1A1 P00352 3/20 0.40
▸ CFD P00746 2/20 0.40
▸ SMN1; SMN2 Q16637 3/20 0.40
▸ GSK3B P49841 1/20 0.40
▸ KMT2A Q03164 2/20 0.39
▸ PRKCQ Q04759 1/20 0.39
▸ MEN1 O00255 1/20 0.39
▸ NPC1 O15118 2/20 0.39
▸ RAB9A P51151 2/20 0.39
▸ HSF1 Q00613 1/20 0.39
▸ HPGD P15428 1/20 0.39
▸ STAT1 P42224 1/20 0.39
▸ CYP1A2 P05177 1/20 0.39
▸ BPTF Q12830 1/20 0.39

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
Hydrochloric Acid SCHEMBL7876724 0.99 BRD4 (0.43) BRD4MAPTL3MBTL1BLMNPSR1
SCHEMBL7880690 0.87 BRD4 (0.39) BRD4MAPTL3MBTL1BLMNPSR1
SCHEMBL7880710 0.86 BRD4 (0.42) BRD4MAPTL3MBTL1BLMNPSR1
SCHEMBL7872403 0.85 TXNRD1 (0.48) MAPTL3MBTL1BLMNPSR1KMT2A
Hydrochloric Acid SCHEMBL7876717 0.85 BRD4 (0.41) BRD4MAPTL3MBTL1BLMNPSR1
SCHEMBL16900176 0.83 RAB9A (0.55) MAPTL3MBTL1BLMNPSR1TDP1
SCHEMBL7883285 0.83 MAOA (0.48) BRD4MAPTALDH1A1CFDGSK3B
SCHEMBL10810171 0.80 GSK3B (0.58) MAPTL3MBTL1TDP1ALDH1A1SMN1; SMN2
Hydrochloric Acid SCHEMBL7880082 0.79 MAPT (0.55) MAPTL3MBTL1ALDH1A1SMN1; SMN2KMT2A
SCHEMBL7883169 0.78 KAT2B (0.51) MAPTL3MBTL1BLMNPSR1TDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1244542-C Aromatic amine derivatives having NOS inhibitory effect CHUGAI PHARMACEUTICAL CO LTD (JP) 2006-03-08 — — CN claimed
US-6331553-B1 INHIBITORS OF NITRIC OXIDE SYNTHASE; TREATING CEREBROVASCULAR DISEASES CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) 2001-12-18 — — US claimed
CN-1240419-A Aromatic amine derivatives having NOS inhibitory effect CHUGAI PHARMACEUTICAL CO LTD (JP) 2000-01-05 — — CN claimed
EP-0949242-A1 AROMATIC AMINE DERIVATIVES HAVING NOS INHIBITORY EFFECT Chugai Seiyaku Kabushiki Kaisha (JP) 1999-10-13 — — EP claimed
CN-1244542-C Aromatic amine derivatives having NOS inhibitory effect CHUGAI PHARMACEUTICAL CO LTD (JP) 2006-03-08 — — CN disclosed
US-6331553-B1 INHIBITORS OF NITRIC OXIDE SYNTHASE; TREATING CEREBROVASCULAR DISEASES CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) 2001-12-18 — — US disclosed
CN-1240419-A Aromatic amine derivatives having NOS inhibitory effect CHUGAI PHARMACEUTICAL CO LTD (JP) 2000-01-05 — — CN disclosed
EP-0949242-A1 AROMATIC AMINE DERIVATIVES HAVING NOS INHIBITORY EFFECT Chugai Seiyaku Kabushiki Kaisha (JP) 1999-10-13 — — EP disclosed
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