SCHEMBL224438

SCHEMBL224438

O=c1[nH]c2cc([N+](=O)[O-])ccc2o1

nearest known ligand 0.69

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PSMB8 P28062 1/20 0.69
NOS3 P29474 3/20 0.54
NOS1 P29475 3/20 0.54
NOS2 P35228 3/20 0.54
GRIA1 P42261 1/20 0.54
GRIA2 P42262 1/20 0.54
GRIA3 P42263 1/20 0.54
GRIA4 P48058 1/20 0.54
LMNA P02545 1/20 0.54
CYP1A2 P05177 1/20 0.54
ADRA2A P08913 1/20 0.54
TSHR P16473 1/20 0.54
THPO P40225 1/20 0.54
BLM P54132 1/20 0.54
NPSR1 Q6W5P4 1/20 0.54
PARP1 P09874 1/20 0.49
PDE3B Q13370 1/20 0.47
PDE3A Q14432 1/20 0.47
DAO P14920 1/20 0.47
CYP3A4 P08684 1/20 0.47

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
SCHEMBL31187650 1.00 PSMB8 (0.69) PSMB8NOS3NOS1NOS2GRIA1
SCHEMBL217228 0.86 NOS1 (0.54) PSMB8NOS1GRIA1GRIA2GRIA3
SCHEMBL30278461 0.81 PSMB8 (1.00) PSMB8NOS1GRIA1GRIA2GRIA3
SCHEMBL2074264 0.81 PSMB8 (1.00) PSMB8NOS1GRIA1GRIA2GRIA3
SCHEMBL3813431 0.80 PARP1 (0.54) PSMB8GRIA1GRIA2GRIA3GRIA4
SCHEMBL2062395 0.80 PARP1 (0.58) PSMB8GRIA1GRIA2GRIA3GRIA4
SCHEMBL31110228 0.80 PARP1 (0.58) PSMB8GRIA1GRIA2GRIA3GRIA4
SCHEMBL29530378 0.77 CA12 (0.58) GRIA1GRIA2GRIA3GRIA4LMNA
SCHEMBL870661 0.77 CA12 (0.58) GRIA1GRIA2GRIA3GRIA4LMNA
SCHEMBL6541777 0.74 PGR (0.58) PSMB8NOS1PDE3BPDE3APOLB

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 121 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117736159-A Preparation method of chlorzoxazone 九江善水科技股份有限公司 2024-03-22 CN claimed
CN-106866449-A A kind of method that the acetyl-anisidine of 2 amino 4 is prepared using 2,4 dinitrophenol hydrogenating reduction by-product recoveries 九江善水科技股份有限公司 2017-06-20 CN claimed
US-20260062416-A1 INHIBITORS OF KIF18A AND USES THEREOF ACCENT THERAPEUTICS INC (US) 2026-03-05 US disclosed
US-20240327390-A1 SUBSTITUTED NITROGEN CONTAINING COMPOUNDS BRISTOL MYERS SQUIBB CO (US) 2024-10-03 US disclosed
EP-3929194-B1 SUBSTITUTED NITROGEN CONTAINING COMPOUNDS BRISTOL MYERS SQUIBB CO (US) 2024-04-17 EP disclosed
CN-117736159-A Preparation method of chlorzoxazone 九江善水科技股份有限公司 2024-03-22 CN disclosed
WO-2024035950-A1 INHIBITORS OF KIF18A AND USES THEREOF ACCENT THERAPEUTICS, INC. (US) 2024-02-15 WO disclosed
WO-2024030651-A1 GPX4 INHIBITORS AND USE THEREOF SONATA THERAPEUTICS, INC. (US) 2024-02-08 WO disclosed
US-RE49700-E1 Substituted nitrogen containing compounds BRISTOL-MYERS SQUIBB COMPANY (US) 2023-10-17 US disclosed
US-RE49700-E1 Substituted nitrogen containing compounds BRISTOL-MYERS SQUIBB COMPANY (US) 2023-10-17 US disclosed
US-RE49700-E1 Substituted nitrogen containing compounds BRISTOL-MYERS SQUIBB COMPANY (US) 2023-10-17 US disclosed
EP-0477819-B1 Benzimidazole derivatives, their preparation and use NEUROSEARCH AS (DK) 1995-03-15 EP disclosed
US-5200422-A Benzimidazole derivatives, their preparation and use NEUROSEARCH A/S (DK) 1993-04-06 US disclosed
EP-0477819-A2 Benzimidazole derivatives, their preparation and use NEUROSEARCH A/S (DK) 1992-04-01 EP disclosed
US-4873338-A Process for the preparation of 2-amino-5-acylamino phenols and starting compounds suitable therefor AGFA-GEVAERT AKTIENGESELLSCHAFT (DE) 1989-10-10 US disclosed
EP-0075533-B1 HEAT-CURABLE EPOXY-RESIN COMPOSITIONS CIBA-GEIGY AG (CH) 1985-08-07 EP disclosed
US-4404356-A USING A 2-HYDROXYPHENYL UREA AS CORING AGENT; STORAGE STABILITY; CASTINGS; MOLDING MATERIALS CIBA-GEIGY CORPORATION (US) 1983-09-13 US disclosed
EP-0075533-A1 Heat-curable epoxy-resin compositions CIBA-GEIGY AG (CH) 1983-03-30 EP disclosed
US-4377695-A ANTIINFLAMMATORY, ANALGESIC, ANTICOAGULANT AGENTS A. NATTERMANN & CIE GMBH (DE) 1983-03-22 US disclosed
EP-0051827-A1 Omega-(2-oxo-benzimidazolinyl)-alkanoic acid derivatives, process for producing the same and pharmaceutical compounds containing the same A. Nattermann & Cie. GmbH (DE) 1982-05-19 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 (2 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-20240327390-A1 SUBSTITUTED NITROGEN CONTAINING COMPOUNDS NR0B1, GRK1, GRIN1 PSMB8 2954/4885NOS3 289/4885NOS1 165/4885
US-20260062416-A1 INHIBITORS OF KIF18A AND USES THEREOF KIF18A, KIF18B, KIF5B PSMB8 887/4885NOS3 4383/4885NOS1 4418/4885

“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.