SCHEMBL2247663

SCHEMBL2247663

O=[N+]([O-])c1ccc2nc(-c3ccc(Cl)cc3)[nH]c2c1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPBWR1 P48145 15/20 1.00
NPC1 O15118 7/20 1.00
MAPT P10636 7/20 1.00
RAB9A P51151 7/20 1.00
SMN1; SMN2 Q16637 6/20 1.00
HTT P42858 5/20 1.00
MEN1 O00255 4/20 1.00
KMT2A Q03164 4/20 1.00
ALDH1A1 P00352 2/20 1.00
LMNA P02545 2/20 1.00
HPGD P15428 1/20 1.00
MMP2 P08253 3/20 0.84
MMP9 P14780 3/20 0.84
MMP8 P22894 3/20 0.84
MMP13 P45452 3/20 0.84
CASP3 P42574 2/20 0.84
SENP8 Q96LD8 2/20 0.84
SENP7 Q9BQF6 2/20 0.84
SENP6 Q9GZR1 2/20 0.84
NFKB1 P19838 3/20 0.76

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
SCHEMBL20982761 0.93 NPC1 (0.97) NPBWR1NPC1MAPTRAB9ASMN1; SMN2
SCHEMBL31474755 0.92 NPBWR1 (0.85) NPBWR1NPC1MAPTRAB9ASMN1; SMN2
SCHEMBL20982700 0.91 NPC1 (0.94) NPBWR1NPC1MAPTRAB9ASMN1; SMN2
SCHEMBL5566191 0.91 NPC1 (1.00) NPBWR1NPC1MAPTRAB9ASMN1; SMN2
SCHEMBL3193088 0.89 NPBWR1 (0.80) NPBWR1NPC1MAPTRAB9ASMN1; SMN2
SCHEMBL3190883 0.86 NPBWR1 (0.80) NPBWR1NPC1MAPTRAB9ASMN1; SMN2
SCHEMBL3183544 0.86 NPC1 (0.84) NPBWR1NPC1MAPTRAB9ASMN1; SMN2
SCHEMBL10117321 0.86 NPBWR1 (1.00) NPBWR1NPC1MAPTRAB9ASMN1; SMN2
SCHEMBL17898263 0.86 NPBWR1 (1.00) NPBWR1NPC1MAPTRAB9ASMN1; SMN2
SCHEMBL31049578 0.86 NPBWR1 (1.00) NPBWR1NPC1MAPTRAB9ASMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20110195932-A1 Drug Combinations for the Treatment of Duchenne Muscular Dystrophy SUMMIT (OXFORD) LIMITED (GB) 2011-08-11 US claimed
CN-118416058-A Application of benzimidazole compound 广州市朝利良生物科技有限公司 2024-08-02 CN disclosed
US-20230348436-A1 COMPOUNDS FOR TREATING TUBERCULOSIS NANYANG TECHNOLOGICAL UNIVERSITY (SG) 2023-11-02 US disclosed
US-20230348436-A1 COMPOUNDS FOR TREATING TUBERCULOSIS NANYANG TECHNOLOGICAL UNIVERSITY (SG) 2023-11-02 US disclosed
EP-3251694-A1 DRUG COMBINATIONS FOR THE TREATMENT OF DUCHENNE MUSCULAR DYSTROPHY Summit (Oxford) Limited (GB) 2017-12-06 EP disclosed
US-20140018320-A1 TREATMENT OF DUCHENNE MUSCULAR DYSTROPHY SUMMIT CORPORATION PLC (GB) 2014-01-16 US disclosed
US-20140011782-A1 DRUG COMBINATIONS FOR THE TREATMENT OF DUCHENNE MUSCULAR DYSTROPHY SUMMIT CORPORATION PLC (GB) 2014-01-09 US disclosed
US-8518980-B2 Treatment of Duchenne muscular dystrophy SUMMIT CORPORATION PLC (GB) 2013-08-27 US disclosed
US-8501713-B2 Drug combinations for the treatment of duchenne muscular dystrophy SUMMIT CORPORATION PLC (GB) 2013-08-06 US disclosed
US-20110195932-A1 Drug Combinations for the Treatment of Duchenne Muscular Dystrophy SUMMIT (OXFORD) LIMITED (GB) 2011-08-11 US disclosed
US-20100120802-A1 Novel Anti-Inflammatory and Analgesic Heterocyclic Amidines that Inhibit Nitrogen Oxide (NO) Production MAKOVEC FRANCESCO 2010-05-13 US disclosed
US-7674809-B2 Anti-inflammatory and analgesic heterocyclic amidines that inhibit nitrogen oxide (NO) production ROTTAPHARM S.P.A. (IT) 2010-03-09 US disclosed
US-20090075938-A1 TREATMENT OF DUCHENNE MUSCULAR DYSTROPHY SUMMIT (OXFORD) LIMITED (GB) 2009-03-19 US disclosed
EP-1986633-A2 TREATMENT OF DUCHENNE MUSCULAR DYSTROPHY Summit Corporation Plc (GB) 2008-11-05 EP disclosed
WO-2007091106-A2 TREATMENT OF DUCHENNE MUSCULAR DYSTROPHY SUMMIT CORPORATION PLC (GB) 2007-08-16 WO disclosed
US-20050197331-A1 Novel anti-inflammatory and analgesic heterocyclic amidines that inhibit nitrogen oxide (NO) production ROTTAPHARM SPA 2005-09-08 US disclosed
EP-1571142-A1 Novel anti-inflammatory and analgesic heterocyclic amidines that inhibit nitrogen oxide (NO) production Rottapharm S.p.A. (IT) 2005-09-07 EP disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (7 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20100120802-A1 Novel Anti-Inflammatory and Analgesic Heterocyclic Amidines that Inhibit Nitrogen Oxide (NO) Production NOS3, NOS1, NOS2 NPBWR1 323/4885NPC1 4082/4885MAPT 4542/4885
US-20110195932-A1 Drug Combinations for the Treatment of Duchenne Muscular Dystrophy PYGM, CPT1B, GYS1 NPBWR1 2640/4885NPC1 2477/4885MAPT 3113/4885
US-20050197331-A1 Novel anti-inflammatory and analgesic heterocyclic amidines that inhibit nitrogen oxide (NO) production NOS3, NOS1, NOS2 NPBWR1 323/4885NPC1 4082/4885MAPT 4542/4885
US-20140011782-A1 DRUG COMBINATIONS FOR THE TREATMENT OF DUCHENNE MUSCULAR DYSTROPHY PYGM, CPT1B, GYS1 NPBWR1 2640/4885NPC1 2477/4885MAPT 3113/4885
US-20230348436-A1 COMPOUNDS FOR TREATING TUBERCULOSIS DOT1L, HAT1, UQCRB NPBWR1 1416/4885NPC1 946/4885MAPT 2454/4885
US-20140018320-A1 TREATMENT OF DUCHENNE MUSCULAR DYSTROPHY NR0B1, NR0B2, NR3C1 NPBWR1 146/4885NPC1 3637/4885MAPT 4858/4885
US-20090075938-A1 TREATMENT OF DUCHENNE MUSCULAR DYSTROPHY NR0B1, NR0B2, NR3C1 NPBWR1 146/4885NPC1 3637/4885MAPT 4858/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.