SCHEMBL1740596

SCHEMBL1740596

Fc1ccc(OC2CNC2)cc1

nearest known ligand 0.59

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
SLC6A2 P23975 6/20 0.53
SLC6A4 P31645 6/20 0.53
SLC6A3 Q01959 4/20 0.53
HTR1A P08908 3/20 0.49
HTR2C P28335 3/20 0.43
HTR2B P41595 3/20 0.43

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
Hydrochloric Acid SCHEMBL797398 0.98 SLC6A2 (0.52) SLC6A2SLC6A4SLC6A3HTR1AHTR2C
SCHEMBL9597404 0.89 SLC6A2 (0.49) SLC6A2SLC6A4SLC6A3
Trifluoroacetic Acid SCHEMBL23830859 0.85 SLC6A2 (0.45) SLC6A2SLC6A4SLC6A3
SCHEMBL4125994 0.84 HTR2C (0.59) SLC6A2SLC6A4SLC6A3HTR1AHTR2C
SCHEMBL17643355 0.84 GRIN1 (0.44) SLC6A2SLC6A4SLC6A3
SCHEMBL4700578 0.84 HTR2C (0.59) SLC6A2SLC6A4SLC6A3HTR1AHTR2C
SCHEMBL2114839 0.84 GRIN1 (0.44) SLC6A2SLC6A4SLC6A3
SCHEMBL2114840 0.84 GRIN1 (0.44) SLC6A2SLC6A4SLC6A3
SCHEMBL3380245 0.84 HTR2C (0.59) SLC6A2SLC6A4SLC6A3HTR1AHTR2C
SCHEMBL17643108 0.84 GRIN1 (0.44) SLC6A2SLC6A4SLC6A3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230183255-A1 PDE9 INHIBITORS WITH IMIDAZO TRIAZINONE BACKBONE AND IMIDAZO PYRAZINONE BACKBONE FOR TREATMENT OF PERIPHERAL DISEASES H. LUNDBECK A/S (DK) 2023-06-15 US claimed
US-20250326713-A1 INHIBITORS OF MsbA AS ANTIBIOTICS, PHARMACEUTICAL COMPOSITIONS, AND USES THEREOF MERCK SHARP & DOHME LLC (US) 2025-10-23 US disclosed
EP-4525852-A1 INHIBITORS OF MSBA AS ANTIBIOTICS, PHARMACEUTICAL COMPOSITIONS, AND USES THEREOF Merck Sharp & Dohme LLC (US) 2025-03-26 EP disclosed
US-20240400578-A1 SUBSTITUTED AZETIDINE DIHYDROTHIENOPYRIDINES AND THEIR USE AS PHOSPHODIESTERASE INHIBITORS UNION therapeutics A/S (DK) 2024-12-05 US disclosed
US-11981681-B2 Substituted azetidine dihydrothienopyridines and their use as phosphodiesterase inhibitors UNION therapeutics A/S (DK) 2024-05-14 US disclosed
EP-3724194-B1 SUBSTITUTED AZETIDINE DIHYDROTHIENOPYRIMIDINES AND THEIR USE AS PHOSPHODIESTERASE INHIBITORS UNION THERAPEUTICS AS (DK) 2023-12-27 EP disclosed
US-11840528-B2 Isoxazolyl ether derivatives as GABAA α5 PAM HOFFMANN-LA ROCHE INC. (US) 2023-12-12 US disclosed
WO-2023224893-A1 INHIBITORS OF MSBA AS ANTIBIOTICS, PHARMACEUTICAL COMPOSITIONS, AND USES THEREOF MERCK SHARP & DOHME LLC (US) 2023-11-23 WO disclosed
CN-111712502-B Substituted azetidine dihydro-thienopyrimidines and their use as phosphodiesterase inhibitors 联合疗法公司 2023-10-27 CN disclosed
US-20230265094-A1 RIPK1 INHIBITORS AND METHODS OF USE MERCK SHARP & DOHME LLC (US) 2023-08-24 US disclosed
EP-2389382-A1 Amino-heterocyclic compounds used as pde9 inhibitors Pfizer Inc. (US) 2011-11-30 EP disclosed
US-8041687-B2 Dynamic generation of XML Schema for backend driven data validation INTERNATIONAL BUSINESS MACHINES CORPORATION (US) 2011-10-18 US disclosed
WO-2011103196-A1 ARYL CARBOXAMIDE DERIVATIVES AS SODIUM CHANNEL INHIBITORS FOR TREATMENT OF PAIN AMGEN INC. (US) 2011-08-25 WO disclosed
US-20100190771-A1 AMINO-HETEROCYCLIC COMPOUNDS PFIZER INC. 2010-07-29 US disclosed
US-20100190771-A1 AMINO-HETEROCYCLIC COMPOUNDS PFIZER INC. 2010-07-29 US disclosed
US-20100190771-A1 AMINO-HETEROCYCLIC COMPOUNDS PFIZER INC. 2010-07-29 US disclosed
WO-2010084438-A1 AMINO-HETEROCYCLIC COMPOUNDS USED AS PDE9 INHIBITORS PFIZER INC. (US) 2010-07-29 WO disclosed
WO-2010084438-A1 AMINO-HETEROCYCLIC COMPOUNDS USED AS PDE9 INHIBITORS PFIZER INC. (US) 2010-07-29 WO disclosed
WO-2003007939-A1 AZETIDINE DERIVATIVES AND THEIR USE AS CCR3 RECEPTOR ANTAGONISTS NOVARTIS AG (CH) 2003-01-30 WO disclosed
US-4031221-A ANALGESICS, TRANQUILIZERS, INDOLE COMPOUNDS AMERICAN HOECHST CORPORATION (US) 1977-06-21 US 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 (7 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-11840528-B2 Isoxazolyl ether derivatives as GABAA α5 PAM GABRA5, GABRA2, GABRB2 SLC6A2 1136/4885SLC6A4 729/4885SLC6A3 710/4885
US-20100190771-A1 AMINO-HETEROCYCLIC COMPOUNDS PDE9A, PDE2A, PDE10A SLC6A2 411/4885SLC6A4 640/4885SLC6A3 122/4885
US-20230183255-A1 PDE9 INHIBITORS WITH IMIDAZO TRIAZINONE BACKBONE AND IMIDAZO PYRAZINONE BACKBONE FOR TREATMENT OF PERIPHERAL DISEASES PDE9A, PDE5A, PDE3A SLC6A2 3880/4885SLC6A4 3337/4885SLC6A3 2912/4885
US-20250326713-A1 INHIBITORS OF MsbA AS ANTIBIOTICS, PHARMACEUTICAL COMPOSITIONS, AND USES THEREOF MSRB3, ARSA, ABCG2 SLC6A2 2932/4885SLC6A4 2421/4885SLC6A3 2474/4885
US-11981681-B2 Substituted azetidine dihydrothienopyridines and their use as phosphodiesterase inhibitors PDE2A, PDE3A, PDE3B SLC6A2 710/4885SLC6A4 1239/4885SLC6A3 484/4885
US-20240400578-A1 SUBSTITUTED AZETIDINE DIHYDROTHIENOPYRIDINES AND THEIR USE AS PHOSPHODIESTERASE INHIBITORS PDE2A, PDE3A, PDE3B SLC6A2 710/4885SLC6A4 1239/4885SLC6A3 484/4885
US-20230265094-A1 RIPK1 INHIBITORS AND METHODS OF USE RIPK1, RIPK2, RIPK3 SLC6A2 4715/4885SLC6A4 4745/4885SLC6A3 4458/4885

“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.