SCHEMBL3701608

SCHEMBL3701608

O=C(Cl)c1cnc(Br)s1

nearest known ligand 0.00

⚠ Novel chemotype — no close known analogue (best Tanimoto < 0.3). Unexplored chemical space relative to ChEMBL.

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
SCHEMBL324369 0.79
SCHEMBL11597189 0.79 HCAR2 (0.39)
SCHEMBL854956 0.77
SCHEMBL1238343 0.77
Hydrochloric Acid SCHEMBL29229113 0.77 HCAR2 (0.57)
SCHEMBL3052942 0.77
Formaldehyde SCHEMBL27847261 0.76 HCAR2 (0.55)
SCHEMBL1435803 0.76
SCHEMBL27582970 0.76
SCHEMBL27805851 0.76 HCAR2 (0.45)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2025119390-A1 P2X7 RECEPTOR ANTAGONIST 四川大学 2025-06-12 WO disclosed
CN-118184647-A P2X7 receptor antagonist 四川大学 2024-06-14 CN disclosed
CN-115894452-B P2X7 receptor inhibitor 四川大学 2024-04-09 CN disclosed
WO-2023091726-A1 INHIBITORS OF CYCLIN‑DEPENDENT KINASE 12 (CDK12) SYROS PHARMACEUTICALS, INC. (US) 2023-05-25 WO disclosed
WO-2023091726-A1 INHIBITORS OF CYCLIN‑DEPENDENT KINASE 12 (CDK12) SYROS PHARMACEUTICALS, INC. (US) 2023-05-25 WO disclosed
CN-115894452-A P2X7 receptor inhibitor 四川大学 2023-04-04 CN disclosed
US-10703748-B2 Diazanaphthalen-3-yl carboxamides and preparation and use thereof SAMUMED, LLC (US) 2020-07-07 US disclosed
US-20190127370-A1 DIAZANAPHTHALEN-3-YL CARBOXAMIDES AND PREPARATION AND USE THEREOF VICKERS-SPLICE CO-INVESTMENT LLC (KY) 2019-05-02 US disclosed
EP-2681205-B1 BIARYL DERIVATIVES AS SELECTIVE 17BETA-HYDROXYSTEROID DEHYDROGENASE TYPE 2 INHIBITORS UNIV SAARLAND (DE) 2016-11-16 EP disclosed
EP-2731932-B1 AMINOMETHYL QUINOLONE COMPOUNDS HOFFMANN LA ROCHE (CH) 2015-12-30 EP disclosed
WO-2010077882-A2 ANTAGONISTS OF LYSOPHOSPHATIDIC ACID RECEPTORS AMIRA PHARMACEUTICALS, INC. (US) 2010-07-08 WO disclosed
WO-2010077882-A2 ANTAGONISTS OF LYSOPHOSPHATIDIC ACID RECEPTORS AMIRA PHARMACEUTICALS, INC. (US) 2010-07-08 WO disclosed
US-20090149650-A1 PROCESS FOR PREPARING 2-AMINOTHIAZOLE-5-AROMATIC CARBOXAMIDES AS KINASE INHIBITORS BRISTOL-MYERS SQUIBB COMPANY 2009-06-11 US disclosed
US-20090149650-A1 PROCESS FOR PREPARING 2-AMINOTHIAZOLE-5-AROMATIC CARBOXAMIDES AS KINASE INHIBITORS BRISTOL-MYERS SQUIBB COMPANY 2009-06-11 US disclosed
US-7323482-B2 Thiazolyl-based compounds useful as kinase inhibitors BRISTOL-MYERS SQUIBB COMPANY (US) 2008-01-29 US disclosed
US-7323482-B2 Thiazolyl-based compounds useful as kinase inhibitors BRISTOL-MYERS SQUIBB COMPANY (US) 2008-01-29 US disclosed
US-20070093537-A1 Thiazolyl-based compounds useful as kinase inhibitors BRISTOL-MYERS SQUIBB COMPANY 2007-04-26 US disclosed
US-20070093537-A1 Thiazolyl-based compounds useful as kinase inhibitors BRISTOL-MYERS SQUIBB COMPANY 2007-04-26 US disclosed
US-7169771-B2 Thiazolyl-based compounds useful as kinase inhibitors BRISTOL-MYERS SQUIBB COMPANY (US) 2007-01-30 US disclosed
US-7169771-B2 Thiazolyl-based compounds useful as kinase inhibitors BRISTOL-MYERS SQUIBB COMPANY (US) 2007-01-30 US disclosed