SCHEMBL1137553

SCHEMBL1137553

CCOC(CC)(OC(=O)CC#N)OC(=O)CC#N

nearest known ligand 0.34

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
MCL1 Q07820 4/20 0.34
MEN1 O00255 2/20 0.33
KMT2A Q03164 2/20 0.33
ALDH1A1 P00352 1/20 0.30
MAPT P10636 1/20 0.30

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
SCHEMBL11185185 0.78 MCL1 (0.40) MCL1MEN1KMT2AALDH1A1MAPT
SCHEMBL20938111 0.75 MCL1 (0.38) MCL1MEN1KMT2AALDH1A1MAPT
SCHEMBL9777751 0.73 MGAM (0.43) ALDH1A1
SCHEMBL9752076 0.73 MGAM (0.33)
SCHEMBL16166684 0.71 ALDH1A1 (0.31) ALDH1A1
SCHEMBL182386 0.71 ALDH1A1 (0.41) MCL1MEN1KMT2AALDH1A1MAPT
SCHEMBL10612910 0.71 DGKA (0.36) MEN1KMT2AALDH1A1MAPT
SCHEMBL9296815 0.69 TSHR (0.30)
SCHEMBL70685 0.69
Hydrochloric Acid SCHEMBL25408509 0.67

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-113416169-B Process for producing cyanuric chloride 营创三征(营口)精细化工有限公司 2022-07-26 CN claimed
CN-112062692-A Preparation method of ethyl ethoxymethylene cyanoacetate 太仓市茜泾化工有限公司 2020-12-11 CN claimed
JP-60181016-A None JP disclosed
CN-108690016-B Pyrazolopyridines and uses thereof 广东东阳光药业有限公司 2022-08-12 CN disclosed
CN-113416169-B Process for producing cyanuric chloride 营创三征(营口)精细化工有限公司 2022-07-26 CN disclosed
CN-113416169-A Process for producing cyanuric chloride 营创三征(营口)精细化工有限公司 2021-09-21 CN disclosed
CN-108727340-B Fluorine substituted indazoles and use thereof 广东东阳光药业有限公司 2020-12-29 CN disclosed
CN-112062692-A Preparation method of ethyl ethoxymethylene cyanoacetate 太仓市茜泾化工有限公司 2020-12-11 CN disclosed
CN-112062692-A Preparation method of ethyl ethoxymethylene cyanoacetate 太仓市茜泾化工有限公司 2020-12-11 CN disclosed
CN-112062692-A Preparation method of ethyl ethoxymethylene cyanoacetate 太仓市茜泾化工有限公司 2020-12-11 CN disclosed
EP-2833886-B1 SUBSTITUTED QUINOLINES AS BRUTON'S TYROSINE KINASE INHIBITORS HANGZHOUDERENYUCHENG BIOTECHNOLOGY LTD (CN) 2020-08-12 EP disclosed
WO-1996034867-A1 PYRIDO[2,3-d]PYRIMIDINES FOR INHIBITING PROTEIN TYROSINE KINASE MEDIATED CELLULAR PROLIFERATION WARNER-LAMBERT COMPANY (US) 1996-11-07 WO disclosed
US-5254688-A Process for producing pyrido[1,2-a]pyrimidine derivative WAKO PURE CHEMICAL INDUSTRIES, LTD. (JP) 1993-10-19 US disclosed
EP-0224842-B1 PYRAZOLESULFONAMIDE DERIVATIVE, PROCESS FOR ITS PRODUCTION AND HERBICIDE CONTAINING IT NISSAN CHEMICAL INDUSTRIES LTD. (JP) 1992-02-05 EP disclosed
EP-0462834-A1 Process for producing pyrido [1,2-a]pyrimidine derivative WAKO PURE CHEMICAL INDUSTRIES, LTD (JP) 1991-12-27 EP disclosed
US-4844728-A Pyrazolesulfonamide derivative, and herbicide containing it NISSAN CHEMICAL INDUSTRIES, LTD. (JP) 1989-07-04 US disclosed
EP-0224842-A2 Pyrazolesulfonamide derivative, process for its production and herbicide containing it NISSAN CHEMICAL INDUSTRIES LTD. (JP) 1987-06-10 EP disclosed
JP-S60181016-A 5-SUBSTITUTED-1-BENZYL-1H-PYRAZOLE(3,4-B)PYRAZINE DERIVATIVE AND ANTITUMOR AGENT CONTAINING SAID COMPOUND LION CORP 1985-09-14 JP disclosed
US-4162226-A Electrostatic toner with an antiplasticizer CHATTERJI ARUN K (US) 1979-07-24 US disclosed
US-4082751-A ANTIALLERGENS BRISTOL-MYERS COMPANY (US) 1978-04-04 US disclosed