SCHEMBL7883169

SCHEMBL7883169

Cc1ccc([N+](=O)[O-])c(Nc2cccc(CN)c2)c1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KAT2B Q92831 3/20 0.51
▸ FBP1 P09467 1/20 0.47
▸ BPTF Q12830 1/20 0.43
▸ CYP3A4 P08684 1/20 0.43
▸ TSHR P16473 1/20 0.43
▸ L3MBTL1 Q9Y468 3/20 0.42
▸ TDP1 Q9NUW8 2/20 0.42
▸ ALDH1A1 P00352 1/20 0.42
▸ MAPK1 P28482 1/20 0.42
▸ CASP7 P55210 1/20 0.42
▸ MAPT P10636 3/20 0.42
▸ HTR6 P50406 1/20 0.42
▸ MEN1 O00255 1/20 0.42
▸ KMT2A Q03164 1/20 0.42
▸ LMNA P02545 1/20 0.41
▸ NPC1 O15118 1/20 0.40
▸ RAB9A P51151 1/20 0.40
▸ ATM Q13315 1/20 0.40
▸ BLM P54132 1/20 0.40
▸ NPSR1 Q6W5P4 1/20 0.40

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
SCHEMBL12786875 0.85 FBP1 (0.59) KAT2BFBP1CYP3A4TSHRL3MBTL1
SCHEMBL7872540 0.84 AKR1C3 (0.53) FBP1L3MBTL1TDP1ALDH1A1MAPK1
SCHEMBL28853179 0.84 TDP1 (0.62) KAT2BBPTFL3MBTL1TDP1ALDH1A1
SCHEMBL2330493 0.81 L3MBTL1 (0.65) KAT2BFBP1CYP3A4TSHRL3MBTL1
SCHEMBL7880687 0.78 BRD4 (0.43) BPTFL3MBTL1TDP1ALDH1A1MAPT
Hydrochloric Acid SCHEMBL7876724 0.77 BRD4 (0.43) BPTFL3MBTL1TDP1ALDH1A1MAPT
SCHEMBL2327163 0.75 L3MBTL1 (0.56) KAT2BFBP1TSHRL3MBTL1TDP1
SCHEMBL14247885 0.75 FBP1 (0.55) FBP1CYP3A4TSHRL3MBTL1TDP1
SCHEMBL4940284 0.74 TDP1 (0.68) FBP1L3MBTL1TDP1ALDH1A1MAPK1
SCHEMBL16767959 0.74 L3MBTL1 (0.60) KAT2BFBP1CYP3A4TSHRL3MBTL1

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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