SCHEMBL2832

SCHEMBL2832

CC(=O)c1cc([N+](=O)[O-])ccc1F

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 7/20 0.55
HIF1A Q16665 1/20 0.55
MAPT P10636 6/20 0.52
THRB P10828 2/20 0.52
MAPK1 P28482 1/20 0.52
CA12 O43570 1/20 0.50
CA9 Q16790 1/20 0.50
SMN1; SMN2 Q16637 2/20 0.49
NPC1 O15118 1/20 0.49
RAB9A P51151 1/20 0.49
L3MBTL1 Q9Y468 2/20 0.49
HTT P42858 3/20 0.47
GAA P10253 1/20 0.47
RORC P51449 1/20 0.46
KMT2A Q03164 2/20 0.46
RXFP1 Q9HBX9 1/20 0.46
MEN1 O00255 1/20 0.46
LMNA P02545 1/20 0.46
SLC6A5 Q9Y345 1/20 0.45
TP53 P04637 1/20 0.45

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
SCHEMBL29554999 1.00 ALDH1A1 (0.55) ALDH1A1HIF1AMAPTTHRBMAPK1
SCHEMBL16960109 0.87 ALDH1A1 (0.56) ALDH1A1HIF1AMAPTTHRBMAPK1
SCHEMBL1360146 0.86 MAPT (0.56) ALDH1A1HIF1AMAPTTHRBMAPK1
SCHEMBL31509357 0.86 MAPT (0.56) ALDH1A1HIF1AMAPTTHRBMAPK1
SCHEMBL2892696 0.84 ALDH1A1 (0.53) ALDH1A1HIF1AMAPTTHRBMAPK1
SCHEMBL31246234 0.84 ALDH1A1 (0.53) ALDH1A1HIF1AMAPTTHRBMAPK1
SCHEMBL4327681 0.84 ALDH1A1 (0.53) ALDH1A1HIF1AMAPTTHRBMAPK1
SCHEMBL195145 0.84 ALDH1A1 (0.59) ALDH1A1HIF1AMAPTSMN1; SMN2HTT
SCHEMBL1654660 0.84 ALDH1A1 (0.59) ALDH1A1HIF1AMAPTSMN1; SMN2HTT
SCHEMBL3656114 0.83 MAPK1 (0.57) ALDH1A1MAPTTHRBMAPK1CA12

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-7196644-A None JP disclosed
US-20260125372-A1 DYNAMIN-1-LIKE PROTEIN INHIBITORS AND USES THEREOF ASTELLAS ENG SMALL MOLECULES US INCORPORATED (US) 2026-05-07 US disclosed
US-20260034140-A1 MODULATORS OF RHO-ASSOCIATED PROTEIN KINASE REDX PHARMA LTD (GB) 2026-02-05 US disclosed
US-20250353819-A1 ARYL HYDANTOIN COMPOUNDS AND METHODS OF USE BOARD OF REGENTS THE UNIV OF NEBRASKA (US) 2025-11-20 US disclosed
US-12453734-B2 Modulators of rho-associated protein kinase REDX PHARMA LIMITED (GB) 2025-10-28 US disclosed
US-20240216386-A1 MODULATORS OF RHO-ASSOCIATED PROTEIN KINASE REDX PHARMA LIMITED (GB) 2024-07-04 US disclosed
CN-114437062-B Compound capable of being used as sodium channel regulator and application thereof 成都海博为药业有限公司 2024-05-17 CN disclosed
US-11878020-B2 Modulators of Rho-associated protein kinase REDX PHARMA PLC (GB) 2024-01-23 US disclosed
WO-2023235480-A1 ARYL HYDANTOIN COMPOUNDS AND METHODS OF USE BOARD OF REGENTS OF THE UNIVERSITY OF NEBRASKA (US) 2023-12-07 WO disclosed
US-20230303497-A1 BENZYLAMINE OR BENZYL ALCOHOL DERIVATIVE AND USES THEREOF CHENGDU HYPERWAY PHARMACEUTICALS CO., LTD (CN) 2023-09-28 US disclosed
WO-1999035132-A1 HETEROCYCLIC COMPOUNDS GLAXO GROUP LIMITED (GB) 1999-07-15 WO disclosed
WO-1999035146-A1 BICYCLIC HETEROAROMATIC COMPOUNDS AS PROTEIN TYROSINE KINASE INHIBITORS GLAXO GROUP LIMITED (GB) 1999-07-15 WO disclosed
EP-0912559-A1 FUSED HETEROCYCLIC COMPOUNDS AS PROTEIN TYROSINE KINASE INHIBITORS GLAXO GROUP LIMITED (GB) 1999-05-06 EP disclosed
EP-0912570-A1 BICYCLIC HETEROAROMATIC COMPOUNDS AS PROTEIN TYROSINE KINASE INHIBITORS GLAXO GROUP LIMITED (GB) 1999-05-06 EP disclosed
EP-0842148-A1 BENZENESULPHONAMIDE DERIVATIVES, PREPARATION THEREOF AND THERAPEUTICAL USES THEREOF SYNTHELABO (FR) 1998-05-20 EP disclosed
WO-1998002434-A1 FUSED HETEROCYCLIC COMPOUNDS AS PROTEIN TYROSINE KINASE INHIBITORS GLAXO GROUP LIMITED (GB) 1998-01-22 WO disclosed
WO-1998002438-A1 BICYCLIC HETEROAROMATIC COMPOUNDS AS PROTEIN TYROSINE KINASE INHIBITORS GLAXO GROUP LIMITED (GB) 1998-01-22 WO disclosed
WO-1997006136-A1 BENZENESULPHONAMIDE DERIVATIVES, PREPARATION THEREOF AND THERAPEUTICAL USES THEREOF SYNTHELABO (FR) 1997-02-20 WO disclosed
JP-H07196644-A BENZOPYRANE DERIVATIVE CHUGAI PHARMACEUT CO LTD 1995-08-01 JP disclosed
US-4801717-A PLANT GROWTH REGULATORS ROUSSEL UCLAF (FR) 1989-01-31 US 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-20260034140-A1 MODULATORS OF RHO-ASSOCIATED PROTEIN KINASE ROCK1, ROCK2, RHOA ALDH1A1 4825/4885HIF1A 4316/4885MAPT 614/4885
US-12453734-B2 Modulators of rho-associated protein kinase ROCK2, ROCK1, RHOA ALDH1A1 4441/4885HIF1A 3233/4885MAPT 909/4885
US-20240216386-A1 MODULATORS OF RHO-ASSOCIATED PROTEIN KINASE ROCK2, ROCK1, RHOA ALDH1A1 4441/4885HIF1A 3233/4885MAPT 909/4885
US-20250353819-A1 ARYL HYDANTOIN COMPOUNDS AND METHODS OF USE XDH, NAT1, HAX1 ALDH1A1 174/4885HIF1A 895/4885MAPT 4764/4885
US-20230303497-A1 BENZYLAMINE OR BENZYL ALCOHOL DERIVATIVE AND USES THEREOF SCN8A, SCN9A, SCN10A ALDH1A1 1050/4885HIF1A 2630/4885MAPT 1923/4885
US-20260125372-A1 DYNAMIN-1-LIKE PROTEIN INHIBITORS AND USES THEREOF DNM1L, DNM1, DNM2 ALDH1A1 4578/4885HIF1A 1995/4885MAPT 1871/4885
US-11878020-B2 Modulators of Rho-associated protein kinase ROCK2, ROCK1, RHOA ALDH1A1 4441/4885HIF1A 3233/4885MAPT 909/4885

“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.