SCHEMBL802854

SCHEMBL802854

Cc1nc(C)nc(Cl)n1

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
SCHEMBL94294 0.92
SCHEMBL9529398 0.79 CYP1A2 (0.44)
SCHEMBL13821081 0.78
SCHEMBL2759574 0.78
SCHEMBL11254 0.78
SCHEMBL92460 0.78
SCHEMBL10028664 0.76 ALDH1A1 (0.35)
SCHEMBL164162 0.74 HSP90AB1 (0.54)
SCHEMBL13500216 0.74 LMNA (0.34)
SCHEMBL2678562 0.74 PDE4A (0.54)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-102229583-B Method for synthesizing cinepazide JIANGSU SHENLONG PHARMACEUTICAL CO LTD 2013-11-27 CN claimed
CN-102229583-A Method for synthesizing cinepazide JIANGSU SHENLONG PHARMACEUTICAL CO LTD 2011-11-02 CN claimed
US-20030064429-A1 Efficient methods for the preparation of rhinovirus protease inhibitors, key intermediates and a continuous membrane reactor useful for preparing the same AGOURON PHARMACEUTICALS, INC. 2003-04-03 US claimed
EP-1206470-A2 PROCESSES AND INTERMEDIATES FOR THE PREPARATION OF ISOXAZOLECARBOXAMIDES AND ANALOGUES AGOURON PHARMACEUTICALS, INC. (US) 2002-05-22 EP claimed
WO-2001014576-A2 PROCESS AND INTERMEDIATES FOR THE PREPARATION OF ISOXAZOLECAROXAMIDES AND ANALOGUES AGOURON PHARMACEUTICALS, INC. (US) 2001-03-01 WO claimed
JP-54077688-A None JP disclosed
US-20260137765-A1 METHODS OF PRODUCING SHIGA TOXIN B-SUBUNIT (STXB) MONOMERS AND OLIGOMERS, AND USES THEREOF INSTITUT CURIE (FR) 2026-05-21 US disclosed
US-12527854-B2 Methods of producing Shiga toxin B-subunit (STxB) monomers and oligomers, and uses thereof INSTITUT CURIE (FR) 2026-01-20 US disclosed
US-20250248207-A1 LIGHT-EMITTING ELEMENT, NITROGEN-CONTAINING COMPOUND FOR LIGHT-EMITTING ELEMENT, AND DISPLAY DEVICE INCLUDING THE LIGHT-EMITTING ELEMENT SAMSUNG DISPLAY CO., LTD. (KR) 2025-07-31 US disclosed
CN-118806965-A High-efficiency hemostatic material and preparation method and application thereof 上海交通大学 2024-10-22 CN disclosed
CN-118434851-A Novel glycoside synthase 碳码股份公司 2024-08-02 CN disclosed
US-12035623-B2 Organic molecules for optoelectronic devices SAMSUNG DISPLAY CO., LTD. (KR) 2024-07-09 US disclosed
US-4726834-A PRE- AND POSTEMERGENCE BAYER AKTIENGESELLSCHAFT (DE) 1988-02-23 US disclosed
EP-0217038-A1 Benzo-[b]-1,4,5,7-dithiadiazepine-1,1,4,4-tetroxide derivatives BAYER AG (DE) 1987-04-08 EP disclosed
EP-0213378-A1 1-(2-Oxyaminosulfonylphenylsulfonyl)-3-triazinyl ureas BAYER AG (DE) 1987-03-11 EP disclosed
EP-0200064-A1 Method for the preparation of 2-cyanamino-4,6-dialkyl-1,3,5-triazines BAYER AG (DE) 1986-11-05 EP disclosed
US-4607063-A FLAME RESISTANCE THE DOW CHEMICAL COMPANY (US) 1986-08-19 US disclosed
US-4556710-A FIREPROOFING FOR POLYURETHANES THE DOW CHEMICAL COMPANY (US) 1985-12-03 US disclosed
JP-S5477688-A PREPARATION OF ADDUCT OF MALEIC ANHYDRIDE WITH LIQUID POLYMER SUMITOMO CHEM CO LTD 1979-06-21 JP disclosed
US-3947374-A Substituted halotriazines as peroxygen bleach activators AMERICAN CYANAMID COMPANY (US) 1976-03-30 US disclosed