SCHEMBL167540

SCHEMBL167540

Cc1csc2ccc(Cl)cc12

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
CYP2A6 P11509 4/20 1.00
KEAP1 Q14145 1/20 0.49
NFE2L2 Q16236 1/20 0.49
SMN1; SMN2 Q16637 1/20 0.44
CA2 P00918 1/20 0.44
ROCK1 Q13464 1/20 0.44
MAPT P10636 6/20 0.42
LMNA P02545 3/20 0.40
TP53 P04637 1/20 0.40
THRB P10828 1/20 0.39
CYP3A4 P08684 1/20 0.39

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
SCHEMBL4210638 0.91 CYP2A6 (0.83) CYP2A6KEAP1NFE2L2SMN1; SMN2CA2
SCHEMBL2092747 0.83 CYP2A6 (0.71) CYP2A6KEAP1NFE2L2SMN1; SMN2CA2
SCHEMBL6422681 0.80 CYP2A6 (0.67) CYP2A6KEAP1NFE2L2SMN1; SMN2CA2
SCHEMBL29017448 0.78 CYP2A6 (0.64) CYP2A6KEAP1NFE2L2SMN1; SMN2CA2
SCHEMBL423281 0.78 CYP2A6 (0.64) CYP2A6CA2MAPTLMNATP53
SCHEMBL8742353 0.78 CYP2A6 (0.60) CYP2A6KEAP1NFE2L2MAPTLMNA
SCHEMBL7917778 0.77 CYP2A6 (0.62) CYP2A6KEAP1NFE2L2SMN1; SMN2CA2
SCHEMBL3682441 0.77 CYP2A6 (0.62) CYP2A6KEAP1NFE2L2SMN1; SMN2CA2
SCHEMBL15191852 0.76 CYP2A6 (0.61) CYP2A6KEAP1NFE2L2SMN1; SMN2CA2
SCHEMBL788066 0.75 CYP2A6 (0.60) CYP2A6CA2MAPTLMNATP53

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20250326790-A1 PEPTIDES BINDING TO HYPOXIA INDUCIBLE FACTORS AND THEIR USE UNIVERSITY OF SOUTHAMPTON (GB) 2025-10-23 US claimed
EP-4298110-A1 PEPTIDES BINDING TO HYPOXIA INDUCIBLE FACTORS AND THEIR USE UNIVERSITY OF SOUTHAMPTON (GB) 2024-01-03 EP claimed
WO-2022180410-A1 PEPTIDES BINDING TO HYPOXIA INDUCIBLE FACTORS AND THEIR USE UNIVERSITY OF SOUTHAMPTON (GB) 2022-09-01 WO claimed
EP-3339302-A1 PYRIDINE DERIVATIVE Teijin Pharma Limited (JP) 2018-06-27 EP claimed
US-20170190694-A1 PYRIDINE DERIVATIVE TEIJIN PHARMA LIMITED (JP) 2017-07-06 US claimed
EP-2944633-A1 PYRIDINE DERIVATIVE Teijin Pharma Limited (JP) 2015-11-18 EP claimed
EP-0853618-B1 SUBSTITUTED (SULFINIC ACID, SULFONIC ACID, SULFONYLAMINO OR SULFINYLAMINO) N- (AMINOIMINOMETHYL)PHENYLALKYL -AZAHETEROCYCLYLAMIDE COMPOUNDS AVENTIS PHARMA INC (US) 2011-08-17 EP claimed
US-20060211603-A1 Ramoplanin derivatives possessing antibacterial activity VICURON PHARMACEUTICALS INC. (US) 2006-09-21 US claimed
US-20250326790-A1 PEPTIDES BINDING TO HYPOXIA INDUCIBLE FACTORS AND THEIR USE UNIVERSITY OF SOUTHAMPTON (GB) 2025-10-23 US disclosed
US-12122742-B2 Small molecule direct inhibitors of KEAP1-NRF2 protein-protein interaction RUTGERS, THE STATE UNIVERSITY OF NEW JERSEY (US) 2024-10-22 US disclosed
EP-4298110-A1 PEPTIDES BINDING TO HYPOXIA INDUCIBLE FACTORS AND THEIR USE UNIVERSITY OF SOUTHAMPTON (GB) 2024-01-03 EP disclosed
US-20230072421-A1 TARGETED RADIOPHARMACEUTICALS FOR THE DIAGNOSIS AND TREATMENT OF PROSTATE CANCER BAYER AS (NO) 2023-03-09 US disclosed
WO-2022180410-A1 PEPTIDES BINDING TO HYPOXIA INDUCIBLE FACTORS AND THEIR USE UNIVERSITY OF SOUTHAMPTON (GB) 2022-09-01 WO disclosed
EP-4003959-A1 TARGETED RADIOPHARMACEUTICALS FOR THE DIAGNOSIS AND TREATMENT OF PROSTATE CANCER Bayer AS (NO) 2022-06-01 EP disclosed
EP-0344979-A2 Alfa-adrenergic receptor antagonists SMITHKLINE BEECHAM CORPORATION (US) 1989-12-06 EP disclosed
EP-0117675-B1 BENZOFURAN AND BENZOTHIOPHENE-CARBOXYLIC-ACID DERIVATIVES BEECHAM GROUP PLC (GB) 1986-07-23 EP disclosed
US-4548948-A Anti-inflammatory and analgesic benzothiophene and benzafuran derivatives, compositions, and method of use therefor BEECHAM GROUP P.L.C. (GB) 1985-10-22 US disclosed
US-4492693-A BACTERICIDES, ANTIBIOTICS ELI LILLY AND COMPANY (US) 1985-01-08 US disclosed
EP-0122154-A2 Improvements in or relating to benzothienylglycyl cephalosporin derivatives ELI LILLY AND COMPANY (US) 1984-10-17 EP disclosed
EP-0117675-A1 Benzofuran and benzothiophene-carboxylic-acid derivatives BEECHAM GROUP PLC (GB) 1984-09-05 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-20230072421-A1 TARGETED RADIOPHARMACEUTICALS FOR THE DIAGNOSIS AND TREATMENT OF PROSTATE CANCER KLK3, AR, SHBG CYP2A6 992/4885KEAP1 2359/4885NFE2L2 1811/4885
US-20250326790-A1 PEPTIDES BINDING TO HYPOXIA INDUCIBLE FACTORS AND THEIR USE HIF1A, HIF1AN, HYOU1 CYP2A6 4527/4885KEAP1 462/4885NFE2L2 57/4885
US-20060211603-A1 Ramoplanin derivatives possessing antibacterial activity CLSPN, LMAN2, RPN2 CYP2A6 3830/4885KEAP1 4633/4885NFE2L2 4610/4885
US-20170190694-A1 PYRIDINE DERIVATIVE HPRT1, XDH, NUDT1 CYP2A6 1634/4885KEAP1 1111/4885NFE2L2 2380/4885
US-12122742-B2 Small molecule direct inhibitors of KEAP1-NRF2 protein-protein interaction KEAP1, NFE2L2, HMOX1 CYP2A6 2283/4885KEAP1 1/4885NFE2L2 2/4885

“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.