SCHEMBL2561631

SCHEMBL2561631

Sc1cc[nH]c1

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
SCHEMBL3691479 0.65 CYP1A2 (0.46)
SCHEMBL275180 0.60
SCHEMBL5828355 0.60
SCHEMBL826848 0.60
SCHEMBL14172909 0.60
SCHEMBL534932 0.60
SCHEMBL47221 0.60
SCHEMBL982077 0.60
SCHEMBL320755 0.60
SCHEMBL152347 0.60

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-112500425-B 3-thiopyrrole compound and synthesis method thereof 太原理工大学 2022-04-15 CN claimed
CN-112500425-A 3-thiopyrrole compound and synthesis method thereof 太原理工大学 2021-03-16 CN claimed
EP-3497519-A1 ENVIROMENTALLY STABLE, THICK FILM, CHEMICALLY AMPLIFIED RESIST Ridgefield Acquisition (LU) 2019-06-19 EP claimed
EP-4288428-A1 AMIDES AS CBL-B INHIBITORS Genentech, Inc. (US) 2023-12-13 EP disclosed
WO-2023154528-A1 STEREOSELECTIVE TECHNOLOGIES FOR CHIRAL COMPOUNDS WAVE LIFE SCIENCES LTD. (SG) 2023-08-17 WO disclosed
US-20230203003-A1 Notch Inhibitors and Uses Thereof STEMSYNERGY THERAPEUTICS, INC. 2023-06-29 US disclosed
US-11621161-B2 Selective deposition of a passivation film on a metal surface APPLIED MATERIALS, INC. (US) 2023-04-04 US disclosed
WO-2022093801-A1 SELECTIVE DEPOSITION OF A PASSIVATION FILM ON A METAL SURFACE APPLIED MATERIALS, INC. (US) 2022-05-05 WO disclosed
US-20220130664-A1 Selective Deposition Of A Passivation Film On A Metal Surface APPLIED MATERIALS, INC. (US) 2022-04-28 US disclosed
CN-112500425-B 3-thiopyrrole compound and synthesis method thereof 太原理工大学 2022-04-15 CN disclosed
CN-112500425-B 3-thiopyrrole compound and synthesis method thereof 太原理工大学 2022-04-15 CN disclosed
WO-1998049150-A1 TRIAZINE DERIVATIVES, THEIR PRODUCTION AND AGROCHEMICAL COMPOSITION TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1998-11-05 WO disclosed
WO-1998006709-A1 CYCLIC UREA COMPOUNDS, THEIR PRODUCTION AND USE AS HERBICIDES TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1998-02-19 WO disclosed
WO-1997011075-A1 TRIAZOLE COMPOUNDS, THEIR PRODUCTION AND USE TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1997-03-27 WO disclosed
EP-0708090-A1 Intermediates useful for the synthesis of pesticides RHONE-POULENC AGROCHIMIE (FR) 1996-04-24 EP disclosed
EP-0305939-B1 Process of producing sulfonylurea derivatives TAKEDA CHEMICAL INDUSTRIES LTD (JP) 1994-11-02 EP disclosed
US-4994571-A Reacting heterocycle-containing sulfonamide compound with carbonyl compound TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1991-02-19 US disclosed
EP-0305939-A1 Process of producing sulfonylurea derivatives Takeda Chemical Industries, Ltd. (JP) 1989-03-08 EP disclosed
US-4729992-A Cephalosporin esters, their production and use TATSUO CHEMICAL IND., LTD. (JP) 1988-03-08 US disclosed
EP-0159899-A2 Cephalosporin esters, their production and use Takeda Chemical Industries, Ltd. (JP) 1985-10-30 EP disclosed