SCHEMBL6407665

SCHEMBL6407665

CCC(C)NC(=O)OCc1ccccc1

nearest known ligand 0.60

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ATM Q13315 1/20 0.59
CTSK P43235 5/20 0.59
CTSS P25774 5/20 0.59
CTSL P07711 4/20 0.59
CTSB P07858 3/20 0.59
SYK P43405 1/20 0.56
MEN1 O00255 1/20 0.56
LMNA P02545 1/20 0.56
KMT2A Q03164 1/20 0.56
CTRB1 P17538 2/20 0.56
ELANE P08246 1/20 0.56
CYP3A4 P08684 1/20 0.54
CYP2D6 P10635 1/20 0.54
CYP2C9 P11712 1/20 0.54
CYP2C19 P33261 1/20 0.54
RAB9A P51151 1/20 0.54
SMN1; SMN2 Q16637 1/20 0.54

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
SCHEMBL14999596 1.00 ATM (0.59) ATMCTSKCTSSCTSLCTSB
SCHEMBL13572927 1.00 ATM (0.59) ATMCTSKCTSSCTSLCTSB
SCHEMBL19569920 0.88 POLB (0.61) ATMCTSKCTSSCTSLCTSB
SCHEMBL4033719 0.87 NPC1 (0.65) ATMCTSKCTSSCTSLCTSB
SCHEMBL13534727 0.87 NPC1 (0.65) ATMCTSKCTSSCTSLCTSB
SCHEMBL398460 0.87 ATM (0.59) ATMCTSKCTSSCTSLCTSB
SCHEMBL5268187 0.87 ATM (0.59) ATMCTSKCTSSCTSLCTSB
SCHEMBL1547277 0.87 ATM (0.59) ATMCTSKCTSSCTSLCTSB
SCHEMBL10189480 0.87 ATM (0.53) ATMCTSKCTSSCTSLCTSB
SCHEMBL5194569 0.86 ATM (0.58) ATMCTSKCTSSCTSLCTSB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2023196556-A1 CANNABINOID RECEPTOR 1 ANTAGONISTS/INVERSE AGONISTS AND USES THEREOF CORBUS PHARMACEUTICALS, INC. (US) 2023-10-12 WO disclosed
CN-111741951-B Amide compound or salt thereof, agricultural/horticultural fungicide containing the same, and method for using the same 日本农药株式会社 2023-08-18 CN disclosed
WO-2019046784-A1 COMPOUNDS AND METHODS FOR MODULATING ADENOSINE A2B RECEPTOR AND ADENOSINE A2A RECEPTOR CORVUS PHARMACEUTICALS, INC. (US) 2019-03-07 WO disclosed
US-20180133244-A1 METHODS AND COMPOSITIONS FOR SELECTIVELY REMOVING POTASSIUM ION FROM THE GASTROINTESTINAL TRACT OF A MAMMAL VIFOR (INTERNATIONAL) LTD. (CH) 2018-05-17 US disclosed
WO-2017190107-A1 SIGMA RECEPTOR BINDERS BOARD OF REGENTS, THE UNIVERSITY OF TEXAS SYSTEM (US) 2017-11-02 WO disclosed
WO-2009153721-A1 NICOTINAMIDE DERIVATIVES PFIZER LIMITED (GB) 2009-12-23 WO disclosed
CN-1309715-C N-acylaminoacetonitrile derivatives and their use for controlling parasites NOVARTIS AG (CH) 2007-04-11 CN disclosed
CN-1649579-A N-acylaminoacetonitrile derivatives and their use for controlling parasites NOVARTIS AG (CH) 2005-08-03 CN disclosed
US-20050042245-A1 Oil-in-water emulsion formulation of insecticides TARANTA CLAUDE (DE) 2005-02-24 US disclosed
CN-1545500-A Carbonyloxy-cyanomethyl compounds as antiparasitic agents 诺瓦提斯公司 2004-11-10 CN disclosed
CN-1193321-A Microbiocidal benzotriazoles compounds BAYER AG (DE) 1998-09-16 CN disclosed
EP-0511948-B1 Preparation of urethane and carbonate products MONSANTO CO (US) 1997-11-05 EP disclosed
US-5371183-A Reacting diamine or polyamine with carbon dioxide in solvent in presence of sterically hindered amidine or guanidine to form salt, reacting with hydrocarbyl dihalide or polyhalide in polar aprotic solvent, polymerizing product MONSANTO COMPANY (US) 1994-12-06 US disclosed
US-5349048-A Reaction of carbon dioxide with alcohol to form salt in solvent and reacting with hydrocarbyl halide MONSANTO COMPANY (US) 1994-09-20 US disclosed
US-5344934-A Reaction of carbon dioxide and amine in aprotic solvents MONSANTO COMPANY (US) 1994-09-06 US disclosed
US-5260473-A Reaction of alcohol and carbon dioxide in aprotic solvent and strong amidine or guanidine base MONSANTO COMPANY (US) 1993-11-09 US disclosed
EP-0556538-A1 Blocked tricarbamate compounds MONSANTO COMPANY (US) 1993-08-25 EP disclosed
CN-1075475-A Process for the preparation of carbamate and carbonate products MONSANTO CO (US) 1993-08-25 CN disclosed
US-5223638-A Reacting primary or secondary amine with carbon dioxide in presence of strong amidine or guanidine base to form ammonium carbamate salt, reacting in polar aprotic solvent with primary or secondary hydrocarbyl halide MONSANTO COMPANY (US) 1993-06-29 US disclosed
EP-0511948-A2 Preparation of urethane and carbonate products MONSANTO COMPANY (US) 1992-11-04 EP disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20180133244-A1 METHODS AND COMPOSITIONS FOR SELECTIVELY REMOVING POTASSIUM ION FROM THE GASTROINTESTINAL TRACT OF A MAMMAL KCNN3, KCNH3, KCNH2 ATM 2975/4885CTSK 1245/4885CTSS 3438/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.