SCHEMBL38645

SCHEMBL38645

N#Cc1cccc(C(=O)CBr)c1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
GSK3B P49841 5/20 1.00
PTPN1 P18031 3/20 0.52
VNN1 O95497 3/20 0.45
GRM5 P41594 1/20 0.44
MEP1A Q16819 1/20 0.43
MEP1B Q16820 1/20 0.43
CLK1 P49759 1/20 0.43
DYRK1A Q13627 1/20 0.43
DYRK1B Q9Y463 1/20 0.43
P4HB P07237 2/20 0.42
GPR139 Q6DWJ6 1/20 0.42
ENPP2 Q13822 1/20 0.42
IRAK4 Q9NWZ3 1/20 0.42
MEN1 O00255 1/20 0.41
ALDH1A1 P00352 1/20 0.41
MAPT P10636 1/20 0.41
KMT2A Q03164 1/20 0.41

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
SCHEMBL29615087 1.00 GSK3B (1.00) GSK3BPTPN1VNN1GRM5MEP1A
SCHEMBL6578442 0.92 GSK3B (0.85) GSK3BPTPN1VNN1GRM5GPR139
SCHEMBL8105775 0.85 GSK3B (0.74) GSK3BVNN1GRM5CLK1DYRK1A
SCHEMBL1712250 0.84 GSK3B (0.72) GSK3BVNN1GRM5CLK1DYRK1A
SCHEMBL16863084 0.82 GSK3B (0.70) GSK3BVNN1GRM5CLK1DYRK1A
SCHEMBL14437408 0.82 GSK3B (0.70) GSK3BVNN1GRM5CLK1DYRK1A
SCHEMBL10745445 0.82 GSK3B (0.70) GSK3BVNN1GRM5CLK1DYRK1A
SCHEMBL311049 0.82 GSK3B (0.70) GSK3BVNN1GRM5CLK1DYRK1A
SCHEMBL12231204 0.82 GSK3B (0.70) GSK3BVNN1GRM5CLK1DYRK1A
SCHEMBL30375734 0.82 GSK3B (0.70) GSK3BVNN1GRM5CLK1DYRK1A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20260092045-A1 SUBSTITUTED BENZOFURAN, BENZOPYRROLE, BENZOTHIOPHENE, AND STRUCTURALLY RELATED COMPLEMENT INHIBITORS WILMINGTON TRUST, NATIONAL ASSOCIATION 2026-04-02 US disclosed
US-20250388582-A1 NOVEL BICYCLIC HETEROARYL COMPOUND AND USE THEREOF ILDONG PHARMACEUTICAL CO LTD (KR) 2025-12-25 US disclosed
EP-4628163-A1 NOVEL HETEROARYL AMINOPROPANOL DERIVATIVES Novartis AG (CH) 2025-10-08 EP disclosed
EP-4620533-A2 ANTAGONIST COMPOUNDS Adorx therapeutics Limited (GB) 2025-09-24 EP disclosed
US-12383560-B2 Compounds and uses thereof FOGHORN THERAPEUTICS INC. (US) 2025-08-12 US disclosed
US-20250243194-A1 ANTAGONIST OF ADENOSINE RECEPTORS JANSSEN PHARMACEUTICA NV (BE) 2025-07-31 US disclosed
EP-4323062-B1 HETEROARYL AMINOPROPANOL DERIVATIVES AS INHIBITORS OF LTA4H NOVARTIS AG (CH) 2025-07-23 EP disclosed
EP-4188924-B1 ANTAGONIST COMPOUNDS ADORX THERAPEUTICS LTD (GB) 2025-06-18 EP disclosed
EP-4556476-A1 NOVEL BICYCLIC HETEROARYL COMPOUND AND USE THEREOF Ildong Pharmaceutical Co., Ltd. (KR) 2025-05-21 EP disclosed
US-20250101013-A1 FUNCTIONALIZED AMINOTHIAZOLES LEADXPRO AG (CH) 2025-03-27 US disclosed
US-5561142-A Substituted sulfonamides as selective β3 agonists for the treatment of diabetes and obesity MERCK & CO., INC. (US) 1996-10-01 US disclosed
US-5541197-A Substituted sulfonamides as selective β3 agonists for the treatment of diabetes and obesity MERCK & CO., INC. (US) 1996-07-30 US disclosed
WO-1996010559-A1 UREA DERIVATIVES AND THEIR USE AS ACAT-INHIBITORS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1996-04-11 WO disclosed
WO-1995029159-A1 SUBSTITUTED SULFONAMIDES AS SELECTIVE β3 AGONISTS FOR THE TREATMENT OF DIABETES AND OBESITY MERCK & CO., INC. (US) 1995-11-02 WO disclosed
US-4683232-A N,N-DIMETHYL-P-(2,3-DIHYDRO-2-OXO-6H-1,3,4 OXADIAZIN-2-YLBENZAMIDE IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1987-07-28 US disclosed
US-4587246-A CARDIOTONIC IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1986-05-06 US disclosed
EP-0052442-B1 HETEROCYCLIC COMPOUNDS IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1985-09-11 EP disclosed
US-4503054-A VASODILATORS IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1985-03-05 US disclosed
US-4423045-A CARDIOVASCULAR DISORDERS IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1983-12-27 US disclosed
EP-0052442-A1 Heterocyclic compounds IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1982-05-26 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 (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-12383560-B2 Compounds and uses thereof VHL, CLN6, TFEB GSK3B 3110/4885PTPN1 4436/4885VNN1 1470/4885
US-20260092045-A1 SUBSTITUTED BENZOFURAN, BENZOPYRROLE, BENZOTHIOPHENE, AND STRUCTURALLY RELATED COMPLEMENT INHIBITORS TFPI, F3, BTK GSK3B 3003/4885PTPN1 182/4885VNN1 1642/4885
US-20250243194-A1 ANTAGONIST OF ADENOSINE RECEPTORS ADORA2B, ADORA2A, ADORA1 GSK3B 1852/4885PTPN1 2883/4885VNN1 2165/4885
US-20250101013-A1 FUNCTIONALIZED AMINOTHIAZOLES ADORA2B, RB1, ADORA3 GSK3B 3066/4885PTPN1 3000/4885VNN1 4091/4885
US-20250388582-A1 NOVEL BICYCLIC HETEROARYL COMPOUND AND USE THEREOF GBA1, PIKFYVE, MAN2B1 GSK3B 3174/4885PTPN1 862/4885VNN1 2217/4885

“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.