SCHEMBL7704791

SCHEMBL7704791

OCC1(c2ccc(F)cc2)CC1

nearest known ligand 0.52

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
SLC6A3 Q01959 5/20 0.52
HSD11B1 P28845 3/20 0.50
SLC6A4 P31645 5/20 0.47
SLC6A2 P23975 2/20 0.47
PRKAB2 O43741 2/20 0.39
PRKAG1 P54619 2/20 0.39
PRKAA2 P54646 2/20 0.39
PRKAA1 Q13131 2/20 0.39
PRKAG3 Q9UGI9 2/20 0.39
PRKAG2 Q9UGJ0 2/20 0.39
PRKAB1 Q9Y478 2/20 0.39
MAOB P27338 2/20 0.39
MAOA P21397 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
SCHEMBL435866 0.90 SLC6A3 (0.67) SLC6A3HSD11B1SLC6A4SLC6A2
SCHEMBL16771203 0.86 SLC6A4 (0.53) SLC6A3HSD11B1SLC6A4SLC6A2
SCHEMBL14341371 0.86 SLC6A3 (0.41) SLC6A3HSD11B1SLC6A4SLC6A2
SCHEMBL11821978 0.85 HSD11B1 (0.46) SLC6A3HSD11B1SLC6A4SLC6A2PRKAB2
SCHEMBL6168782 0.83 OPRM1 (0.50) SLC6A3HSD11B1SLC6A4SLC6A2
SCHEMBL11920268 0.80 SLC6A4 (0.41) SLC6A3HSD11B1SLC6A4SLC6A2
SCHEMBL5484212 0.80 SLC6A4 (0.41) SLC6A3HSD11B1SLC6A4SLC6A2
SCHEMBL5484210 0.80 SLC6A4 (0.41) SLC6A3HSD11B1SLC6A4SLC6A2
SCHEMBL2513034 0.79 SLC6A4 (0.48) SLC6A3HSD11B1SLC6A4SLC6A2
SCHEMBL2425390 0.79 HSD11B1 (0.49) SLC6A3HSD11B1

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 17 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4743174-A1 MODULATORS OF CALCITONIN RECEPTOR AND/OR AMYLIN RECEPTOR ACTIVITY Aconcagua Bio, Inc. (US) 2026-05-20 EP disclosed
US-20250042916-A1 COMPOUNDS, COMPOSITIONS, AND METHODS ACONCAGUA BIO, INC. 2025-02-06 US disclosed
WO-2025015268-A1 MODULATORS OF CALCITONIN RECEPTOR AND/OR AMYLIN RECEPTOR ACTIVITY ACONCAGUA BIO, INC. (US) 2025-01-16 WO disclosed
WO-2021071843-A1 MUSCARINIC ACETYLCHOLINE M1 RECEPTOR ANTAGONISTS Pipeline Therapeutics, Inc. (US) 2021-04-15 WO disclosed
US-10221156-B2 Pyridin-3-yl acetic acid derivatives as inhibitors of human immunodeficiency virus replication VIIV Healthcare UK (No.5) Limited (GB) 2019-03-05 US disclosed
US-20180162831-A1 PYRIDIN-3-YL ACETIC ACID DERIVATIVES AS INHIBITORS OF HUMAN IMMUNODEFICIENCY VIRUS REPLICATION VIIV Healthcare UK (No.5) Limited (GB) 2018-06-14 US disclosed
CN-107835808-A The acetic acid derivatives of pyridine 3 of the inhibitor replicated as human immunodeficiency virus VIIV保健英国第五有限公司 2018-03-23 CN disclosed
US-9738642-B2 Triazolopyridine ether derivatives and their use in neurological and pyschiatric disorders BRISTOL-MYERS SQUIBB COMPANY (US) 2017-08-22 US disclosed
US-20160237081-A1 TRIAZOLOPYRIDINE ETHER DERIVATIVES AND THEIR USE IN NEUROLOGICAL AND PYSCHIATRIC DISORDERS BRISTOL MYERS SQUIBB CO (US) 2016-08-18 US disclosed
EP-0900218-B1 HETEROCYCLIC COMPOUNDS LILLY CO ELI (US) 2002-07-24 EP disclosed
EP-0900218-A4 HETEROCYCLIC COMPOUNDS LILLY CO ELI (US) 2001-05-23 EP disclosed
US-6117883-A Heterocyclic compounds ELI LILLY AND COMPANY (US) 2000-09-12 US disclosed
EP-0900218-A1 HETEROCYCLIC COMPOUNDS ELI LILLY AND COMPANY (US) 1999-03-10 EP disclosed
WO-1997040044-A1 HETEROCYCLIC COMPOUNDS ELI LILLY AND COMPANY (US) 1997-10-30 WO disclosed
EP-0094085-B1 ETHER COMPOUNDS, THEIR PRODUCTION AND AN INSECTICIDAL AND/OR ACARICIDAL COMPOSITION CONTAINING THE SAME SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1986-01-02 EP disclosed
US-4562213-A Certain phenoxy-benzyloxy ether derivatives and an insecticidal and/or acaricidal composition containing the same and methods of use SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1985-12-31 US disclosed
EP-0094085-A1 Ether compounds, their production and an insecticidal and/or acaricidal composition containing the same SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1983-11-16 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 (4 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-20180162831-A1 PYRIDIN-3-YL ACETIC ACID DERIVATIVES AS INHIBITORS OF HUMAN IMMUNODEFICIENCY VIRUS REPLICATION TYMP, TYMS, DUT SLC6A3 3469/4885HSD11B1 1683/4885SLC6A4 3671/4885
US-20160237081-A1 TRIAZOLOPYRIDINE ETHER DERIVATIVES AND THEIR USE IN NEUROLOGICAL AND PYSCHIATRIC DISORDERS GRM2, GRIK2, GRIA2 SLC6A3 508/4885HSD11B1 3905/4885SLC6A4 906/4885
US-10221156-B2 Pyridin-3-yl acetic acid derivatives as inhibitors of human immunodeficiency virus replication TYMP, TYMS, DUT SLC6A3 3469/4885HSD11B1 1683/4885SLC6A4 3671/4885
US-20250042916-A1 COMPOUNDS, COMPOSITIONS, AND METHODS IAPP, GIPR, GPR119 SLC6A3 2326/4885HSD11B1 3474/4885SLC6A4 2422/4885

“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.