SCHEMBL299989

SCHEMBL299989

CN(C)C(C)(C)[C]=O

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
SCHEMBL1726984 0.71
SCHEMBL27470387 0.69
SCHEMBL1035597 0.69
SCHEMBL1036555 0.65
SCHEMBL2443389 0.64
SCHEMBL10522467 0.63
SCHEMBL2618 0.62
Hydrochloric Acid SCHEMBL31083339 0.62
SCHEMBL15600927 0.62
SCHEMBL16804666 0.62 LMNA (0.55)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-102827091-A Triazine mercapto derivate as well as preparation method and application thereof UNIV SHANDONG 2012-12-19 CN claimed
CN-102276535-A Azazine mercaptoacetamide derivative and preparation method and application thereof 2011-12-14 CN claimed
JP-4508413-B2 2010-07-21 JP claimed
US-20060270606-A1 Dolastatin 15 derivatives ABBOTT GMBH & CO., KG (DE) 2006-11-30 US claimed
US-20030153505-A1 Dolastatin 15 derivatives BASF AKTIENGESELLSCHAFT (DE) 2003-08-14 US claimed
US-6143721-A FOR TREATING CANCER IN MAMMALS BASF AKTIENGESELLSCHAFT (DE) 2000-11-07 US claimed
EP-0991658-A1 DOLASTATIN 15 DERIVATIVES BASF AKTIENGESELLSCHAFT (DE) 2000-04-12 EP claimed
WO-1999003879-A1 DOLASTATIN 15 DERIVATIVES BASF AKTIENGESELLSCHAFT (DE) 1999-01-28 WO claimed
EP-0129846-B1 (3-AMINO-1H-PYRAZOL-4-YL)(ARYL)METHANONES AMERICAN CYANAMID COMPANY (US) 1991-05-08 EP claimed
EP-0129846-A2 (3-Amino-1H-pyrazol-4-yl)(aryl)methanones AMERICAN CYANAMID COMPANY (US) 1985-01-02 EP claimed
CN-115551839-B Heteroaryl-triazole compounds as pesticides 拜耳公司 2024-06-04 CN disclosed
CN-118103364-A Pyrazinyl-triazole compounds as pesticides 拜耳公司 2024-05-28 CN disclosed
EP-3189083-B2 POLYCYCLIC PHOTOINITIATORS IGM GROUP B V (NL) 2023-07-05 EP disclosed
CN-114423748-A Novel heteroaryl triazole compounds as pesticides 拜耳公司 2022-04-29 CN disclosed
US-10981897-B2 Heteroaryl-1,2,4-triazole and heteroaryl-tetrazole compounds for controlling ectoparasites ELANCO TIERGESUNDHEIT AG (US) 2021-04-20 US disclosed
EP-0129846-B1 (3-AMINO-1H-PYRAZOL-4-YL)(ARYL)METHANONES AMERICAN CYANAMID COMPANY (US) 1991-05-08 EP disclosed
US-4980472-A REACTING ACETONITRILE DERIVATIVE WITH AMINOGUANIDINE DERIVATIVE AMERICAN CYANAMID COMPANY (US) 1990-12-25 US disclosed
US-4900836-A (3-amino-1H-pyrazol-4-yl) (aryl)methanones AMERICAN CYANAMID COMPANY (US) 1990-02-13 US disclosed
CN-87106838-A Tricyclic compound 1988-05-11 CN disclosed
EP-0129846-A2 (3-Amino-1H-pyrazol-4-yl)(aryl)methanones AMERICAN CYANAMID COMPANY (US) 1985-01-02 EP disclosed