SCHEMBL7709423

SCHEMBL7709423

O=C1c2cccc3cc([N+](=O)[O-])cc(c23)C(=O)N1OCc1ccccc1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ NTRK1 P04629 1/20 0.57
▸ NGFR P08138 1/20 0.57
▸ MEN1 O00255 4/20 0.56
▸ KMT2A Q03164 4/20 0.56
▸ FTO Q9C0B1 2/20 0.55
▸ PABPC1 P11940 2/20 0.55
▸ POLB P06746 4/20 0.54
▸ MAPT P10636 3/20 0.54
▸ HTT P42858 2/20 0.54
▸ KDM4E B2RXH2 2/20 0.54
▸ S1PR1 P21453 1/20 0.54
▸ RAD52 P43351 1/20 0.54
▸ RECQL P46063 1/20 0.54
▸ RAB9A P51151 1/20 0.54
▸ PAX8 Q06710 1/20 0.54
▸ CA12 O43570 3/20 0.53
▸ CA1 P00915 3/20 0.53
▸ CA2 P00918 3/20 0.53
▸ CA9 Q16790 3/20 0.53
▸ CLTC Q00610 2/20 0.53

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
SCHEMBL3856490 0.82 CA12 (0.76) NTRK1NGFRMEN1KMT2AFTO
SCHEMBL7703774 0.82 TDP1 (0.50) MEN1KMT2AMAPTHTTKDM4E
SCHEMBL7703791 0.82 MAPT (0.49) MEN1KMT2AMAPTHTTKDM4E
SCHEMBL7706716 0.81 MAPT (0.57) MEN1KMT2AMAPTHTTKDM4E
SCHEMBL13495360 0.80 FTO (0.61) NTRK1NGFRMEN1KMT2AFTO
SCHEMBL5532596 0.79 ALDH1A1 (0.58) MEN1KMT2APOLBMAPTHTT
SCHEMBL717142 0.78 CA12 (0.74) NTRK1NGFRMEN1KMT2AFTO
SCHEMBL28125149 0.77 MEN1 (0.64) NTRK1NGFRMEN1KMT2AFTO
SCHEMBL659165 0.77 KMT2A (0.63) MEN1KMT2APOLBMAPTHTT
SCHEMBL7703716 0.76 MEN1 (0.62) NTRK1NGFRMEN1KMT2APOLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6362181-B1 BACTERICIDES; ENZYME INHIBITORS; ANTITUMOR AGENTS WARNER-LAMBERT COMPANY 2002-03-26 — — US disclosed
US-6177423-B1 N-(HYDROXY OR PROTECTED HYDROXY)-BENZO(DE)ISOQUINOLINE-1,3-DIONE DERIVATIVES; BACTERIAL DNA GYRASE AND DNA TOPOISOMERASE INHIBITORS USEFUL FOR ANTIBACTERIAL AGENTS HAVING REDUCED DRUG RESISTANCE AND REDUCED SIDE EFFECTS WARNER-LAMBERT COMPANY 2001-01-23 — — US disclosed
EP-0939754-A2 N-OXY-NAPHTHALIMIDES AS ANTIBACTERIAL AGENTS WARNER-LAMBERT COMPANY (US) 1999-09-08 — — EP disclosed
WO-1998019648-A2 N-OXY-NAPHTHALIMIDES AS ANTIBACTERIAL AGENTS WARNER-LAMBERT COMPANY (US) 1998-05-14 — — WO disclosed
Send feedback