SCHEMBL142523

SCHEMBL142523

N#Cc1cc(Br)ccc1I

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAOB P27338 4/20 0.41
MAOA P21397 3/20 0.41
SLC1A5 Q15758 1/20 0.37
GRM4 Q14833 1/20 0.36
CHEK1 O14757 1/20 0.35
MCL1 Q07820 1/20 0.34
LMNA P02545 2/20 0.34
MAPK1 P28482 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
DYRK1A Q13627 1/20 0.33
BACE1 P56817 1/20 0.33
NOS3 P29474 1/20 0.33
NOS1 P29475 1/20 0.33
NOS2 P35228 1/20 0.33
TTR P02766 1/20 0.32
ALB P02768 1/20 0.32
CYP11B1 P15538 1/20 0.32
CYP11B2 P19099 1/20 0.32
XDH P47989 1/20 0.31
NPSR1 Q6W5P4 1/20 0.31

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
SCHEMBL29439578 1.00 MAOB (0.41) MAOBMAOASLC1A5GRM4CHEK1
SCHEMBL16534885 0.82 MAOB (0.50) MAOBMAOASLC1A5CHEK1MCL1
SCHEMBL3951343 0.80 AAK1 (0.34) MAOBMAOALMNABACE1NOS3
SCHEMBL30475151 0.78 MAOB (0.61) MAOBMAOASLC1A5CHEK1MCL1
SCHEMBL1395661 0.78 MAOB (0.61) MAOBMAOASLC1A5CHEK1MCL1
SCHEMBL28628169 0.78 CYP2A6 (0.42) MAOBMAOASLC1A5CHEK1MCL1
SCHEMBL28628069 0.78 CYP2A6 (0.42) MAOBMAOASLC1A5CHEK1MCL1
SCHEMBL16956612 0.77 CYP2A6 (0.30)
SCHEMBL31310581 0.76 MAOB (0.44) MAOBMAOASLC1A5CHEK1MCL1
SCHEMBL1914246 0.76 GRM4 (0.38) GRM4DYRK1ATTRALBXDH

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12617789-B2 Small molecular inhibitors of NF-κb inducing kinase JANSSEN PHARMACEUTICA NV (BE) 2026-05-05 US disclosed
US-12606522-B2 Sulfinylaminobenzamide and sulfonylaminobenzamide derivatives ORSOBIO, INC. (US) 2026-04-21 US disclosed
EP-4051667-B1 HETEROCYCLIC CARBOXYLATE COMPOUNDS AS GLYCOLATE OXIDASE INHIBITORS LILAC THERAPEUTICS INC (US) 2026-01-28 EP disclosed
EP-4373817-B1 SUBSTITUTED PYRAZINE-2-CARBOXAMIDES AS HPK1 INHIBITORS FOR THE TREATMENT OF CANCER ASTRAZENECA AB (SE) 2025-05-21 EP disclosed
CN-114929676-B Heterocyclic carboxylate compounds as glycolate oxidase inhibitors 紫丁香疗法有限公司 2025-04-29 CN disclosed
WO-2025073270-A1 BIPHENYL TETRAHYDROPYRROLE COMPOUND, PREPARATION METHOD THEREFOR AND USE THEREOF 海南因瑞生物医药科技有限公司 2025-04-10 WO disclosed
WO-2025056068-A1 BICYCLIC COMPOUND, AND PREPARATION METHOD THEREFOR AND PHARMACEUTICAL USE THEREOF 上海济煜医药科技有限公司 2025-03-20 WO disclosed
US-20250064787-A1 Heterocyclic Carboxylate Compounds as Glycolate Oxidase Inhibitors LILAC THERAPEUTICS INC (US) 2025-02-27 US disclosed
WO-2025021182-A1 CYP11A1 INHIBITORS ACERAND THERAPEUTICS (HONG KONG) LIMITED (CN) 2025-01-30 WO disclosed
US-12168002-B2 Heterocyclic carboxylate compounds as glycolate oxidase inhibitors Lilac Therapeutics, Inc. (US) 2024-12-17 US disclosed
EP-1776100-A2 TREATMENT OF CANCER USING BENZOIC ACID DERIVATIVES NEW YORK UNIVERSITY (US) 2007-04-25 EP disclosed
CN-1894225-A (3, 4-disubstituted) propanoates as sphingosine 1-phosphate (endothelial differentiation gene) receptor agonists MERCK & CO INC (US) 2007-01-10 CN disclosed
EP-1697333-A1 (3,4-DISUBSTITUTED)PROPANOIC CARBOXYLATES AS S1P (EDG) RECEPTOR AGONISTS Merck & Co., Inc. (US) 2006-09-06 EP disclosed
US-20050209334-A1 method of treating cancer using benzoic acid derivatives, alone or in combination with standard treatments such as chemotherapy and radiotherapy methods of screening for benzoic derivatives based on their ability to inhibit the enzyme tyrosinase or to bind to and activate PXR/SXR xenobiotic receptors. NEW YORK UNIVERSITY (US) 2005-09-22 US disclosed
WO-2005070024-A2 TREATMENT OF CANCER USING BENZOIC ACID DERIVATIVES NEW YORK UNIVERSITY (US) 2005-08-04 WO disclosed
WO-2005058848-A1 (3,4-DISUBSTITUTED)PROPANOIC CARBOXYLATES AS S1P (EDG) RECEPTOR AGONISTS MERCK & CO., INC. (US) 2005-06-30 WO disclosed
US-5358663-A Liquid crystals THE SECRETARY OF STATE FOR DEFENCE IN HER BRITANNIC MAJESTY'3 S GOVERNMENT OF U.K. OF GT. BRITAIN AND N. IRELAND (GB) 1994-10-25 US disclosed
EP-0395666-B1 LATERALLY CYANO- AND FLUORO-SUBSTITUTED TERPHENYLS SECR DEFENCE BRIT (GB) 1994-05-04 EP disclosed
EP-0395666-A1 LATERALLY CYANO- AND FLUORO-SUBSTITUTED TERPHENYLS. SECR DEFENCE BRIT (GB) 1990-11-07 EP disclosed
WO-1989003821-A1 LATERALLY CYANO- AND FLUORO-SUBSTITUTED TERPHENYLS THE SECRETARY OF STATE FOR DEFENCE IN HER BRITANNI (GB) 1989-05-05 WO 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 (5 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-20050209334-A1 method of treating cancer using benzoic acid derivatives, alone or in combination with standard treatments such as chemotherapy and radiotherapy methods of screening for benzoic derivatives based on their ability to inhibit the enzyme tyrosinase or to bind to and activate PXR/SXR xenobiotic receptors. AHR, TYR, CYP4X1 MAOB 235/4885MAOA 175/4885SLC1A5 1251/4885
US-12606522-B2 Sulfinylaminobenzamide and sulfonylaminobenzamide derivatives NR3C2, NR5A1, SRD5A2 MAOB 1164/4885MAOA 1774/4885SLC1A5 210/4885
US-12617789-B2 Small molecular inhibitors of NF-κb inducing kinase IRAK3, IKBKB, IKBKG MAOB 4372/4885MAOA 4530/4885SLC1A5 3988/4885
US-12168002-B2 Heterocyclic carboxylate compounds as glycolate oxidase inhibitors UGDH, PGD, PNPO MAOB 51/4885MAOA 75/4885SLC1A5 1913/4885
US-20250064787-A1 Heterocyclic Carboxylate Compounds as Glycolate Oxidase Inhibitors GLS, DUOX1, HAO1 MAOB 289/4885MAOA 397/4885SLC1A5 2793/4885

“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.