SCHEMBL2669664

SCHEMBL2669664

NC1CCCc2ccncc21

nearest known ligand 0.58

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
CHRNB2 P17787 3/20 0.58
CHRNA4 P43681 3/20 0.58
SIGMAR1 Q99720 1/20 0.48
CHRNA7 P36544 1/20 0.46
CYP11B1 P15538 3/20 0.42
CYP11B2 P19099 3/20 0.42
FDPS P14324 1/20 0.42
ACHE P22303 1/20 0.38
ALDH1A1 P00352 1/20 0.37
TSHR P16473 1/20 0.37

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
SCHEMBL12993347 1.00 CHRNB2 (0.58) CHRNB2CHRNA4SIGMAR1CHRNA7CYP11B1
SCHEMBL23756600 1.00 CHRNB2 (0.58) CHRNB2CHRNA4SIGMAR1CHRNA7CYP11B1
SCHEMBL29668817 1.00 CHRNB2 (0.58) CHRNB2CHRNA4SIGMAR1CHRNA7CYP11B1
Hydrochloric Acid SCHEMBL18228119 0.98 CHRNB2 (0.57) CHRNB2CHRNA4SIGMAR1CHRNA7CYP11B1
Hydrochloric Acid SCHEMBL18228121 0.98 CHRNB2 (0.57) CHRNB2CHRNA4SIGMAR1CHRNA7CYP11B1
Hydrochloric Acid SCHEMBL18228516 0.98 CHRNB2 (0.57) CHRNB2CHRNA4SIGMAR1CHRNA7CYP11B1
Hydrochloric Acid SCHEMBL20186895 0.98 CHRNB2 (0.57) CHRNB2CHRNA4SIGMAR1CHRNA7CYP11B1
SCHEMBL18795036 0.89 CHRNB2 (0.53) CHRNB2CHRNA4SIGMAR1CHRNA7CYP11B1
SCHEMBL2687753 0.85 SIGMAR1 (0.48) CHRNB2CHRNA4SIGMAR1CHRNA7CYP11B1
SCHEMBL5051448 0.85 SIGMAR1 (0.48) CHRNB2CHRNA4SIGMAR1CHRNA7CYP11B1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230159510-A1 NOVEL PRMT5 INHIBITORS AMGEN INC. (US) 2023-05-25 US disclosed
EP-4103558-A1 NOVEL PRMT5 INHIBITORS Amgen Inc. (US) 2022-12-21 EP disclosed
US-11518764-B2 Substituted heteroaryls as inhibitors of the BCL6 BTB domain protein-protein interaction ONTARIO INSTITUTE FOR CANCER RESEARCH (OICR) (CA) 2022-12-06 US disclosed
US-11518764-B2 Substituted heteroaryls as inhibitors of the BCL6 BTB domain protein-protein interaction ONTARIO INSTITUTE FOR CANCER RESEARCH (OICR) (CA) 2022-12-06 US disclosed
EP-3749672-B1 INHIBITORS OF THE BCL6 BTB DOMAIN PROTEIN-PROTEIN INTERACTION AND USES THEREOF ONTARIO INSTITUTE FOR CANCER RES OICR (CA) 2022-07-27 EP disclosed
US-11351173-B2 Substituted pyrrolo[1,2-a]pyrimidines and their use in the treatment of medical disorders Bial—R&D Investments, S.A. (PT) 2022-06-07 US disclosed
CN-110325531-B Benzenesulfonamides and their use as therapeutic agents 泽农医药公司 2022-05-27 CN disclosed
US-11174268-B2 Benzenesulfonamide compouds and their use as therapeutic agents XENON PHARMACEUTICALS INC. (CA) 2021-11-16 US disclosed
WO-2021163344-A1 NOVEL PRMT5 INHIBITORS AMGEN INC. (US) 2021-08-19 WO disclosed
US-20210177853-A1 SUBSTITUTED PYRROLO[1,2-A]PYRIMIDINES AND THEIR USE IN THE TREATMENT OF MEDICAL DISORDERS BIAL - R&D INVESTMENTS, S.A. (PT) 2021-06-17 US disclosed
CN-103827101-B Dicyclo dihydroquinoline-2-ketone derivatives 霍夫曼-拉罗奇有限公司 2016-12-07 CN disclosed
EP-3078662-A1 PYRIDIN-2-YL-AMINO-1,2,4-THIADIAZOLE DERIVATIVES AS GLUCOKINASE ACTIVATORS FOR THE TREATMENT OF DIABETES MELLITUS Array Biopharma, Inc. (US) 2016-10-12 EP disclosed
WO-2016073891-A1 SUBSTITUTED PYRROLO[1,2-A]PYRIMIDINES AND THEIR USE IN THE TREATMENT OF MEDICAL DISORDERS LYSOSOMAL THERAPEUTICS INC. (US) 2016-05-12 WO disclosed
EP-2727910-B1 Pyridin-2-yl-thiourea and Pyridin-2-yl-amine derivatives as intermediates for the preparation of Pyridin-2yl-amino-1,2,4-thiadiazole glucokinase activators ARRAY BIOPHARMA INC (US) 2016-03-16 EP disclosed
CN-104245674-A Novel phenyl-tetrahydroisoquinoline derivatives HOFFMANN LA ROCHE 2014-12-24 CN disclosed
EP-2727910-A1 Pyridin-2-yl-thiourea and Pyridin-2-yl-amine derivatives as intermediates for the preparation of Pyridin-2yl-amino-1,2,4-thiadiazole glucokinase activators Array Biopharma, Inc. (US) 2014-05-07 EP disclosed
EP-2573087-A1 Pyridin-2-yl-amino-1,2,4-thiadiazole derivatives as glucokinase activators for the treatment of diabetes mellitus Array Biopharma, Inc. (US) 2013-03-27 EP disclosed
EP-2209778-B1 PYRIDIN-2 -YL-AMINO-I, 2, 4 -THIADIAZOLE DERIVATIVES AS GLUCOKINASE ACTIVATORS FOR THE TREATMENT OF DIABETES MELLITUS ARRAY BIOPHARMA INC (US) 2012-08-29 EP disclosed
WO-2008118718-A2 2-AMINOPYRIDINE ANALOGS AS GLUCOKINASE ACTIVATORS ARRAY BIOPHARMA INC. (US) 2008-10-02 WO disclosed
WO-2003014089-A1 AMINOTETRAHYDROISOQUINOLINE DERIVATIVES AS ANALGESICS VIRGINIA COMMONWEALTH UNIVERSITY (US) 2003-02-20 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-11518764-B2 Substituted heteroaryls as inhibitors of the BCL6 BTB domain protein-protein interaction BCL6, BCL6B, BCL3 CHRNB2 4817/4885CHRNA4 4875/4885SIGMAR1 4315/4885
US-11351173-B2 Substituted pyrrolo[1,2-a]pyrimidines and their use in the treatment of medical disorders TYMP, PARK7, PNP CHRNB2 2299/4885CHRNA4 2426/4885SIGMAR1 3683/4885
US-20210177853-A1 SUBSTITUTED PYRROLO[1,2-A]PYRIMIDINES AND THEIR USE IN THE TREATMENT OF MEDICAL DISORDERS TYMP, PARK7, PNP CHRNB2 2299/4885CHRNA4 2426/4885SIGMAR1 3683/4885
US-20230159510-A1 NOVEL PRMT5 INHIBITORS PRMT5, PRMT1, PRMT3 CHRNB2 4331/4885CHRNA4 4335/4885SIGMAR1 4558/4885
US-11174268-B2 Benzenesulfonamide compouds and their use as therapeutic agents KCND2, SCN1A, CACNA1D CHRNB2 648/4885CHRNA4 596/4885SIGMAR1 2733/4885

“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.