SCHEMBL3677658

SCHEMBL3677658

CCC/C(=C/C(N)=O)C(=O)O

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FFAR3 O14843 3/20 0.40
HDAC3 O15379 3/20 0.40
HDAC1 Q13547 3/20 0.40
HDAC2 Q92769 3/20 0.40
HDAC8 Q9BY41 3/20 0.40
POLB P06746 1/20 0.36
GRIK1 P39086 4/20 0.36
GRIK2 Q13002 3/20 0.36
CES2 O00748 1/20 0.36
CES1 P23141 1/20 0.36
CTSD P07339 1/20 0.34
TSHR P16473 2/20 0.33
KDM4E B2RXH2 1/20 0.33
MEN1 O00255 1/20 0.32
FAAH O00519 1/20 0.32
TP53 P04637 1/20 0.32
CYP1A2 P05177 1/20 0.32
CYP3A4 P08684 1/20 0.32
CYP2C19 P33261 1/20 0.32
SOAT1 P35610 1/20 0.32

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
SCHEMBL3677661 1.00 FFAR3 (0.40) FFAR3HDAC3HDAC1HDAC2HDAC8
Dimethylamine SCHEMBL28092119 0.94 HDAC3 (0.36) FFAR3HDAC3HDAC1HDAC2HDAC8
SCHEMBL9330021 0.87 CES1 (0.41) GRIK1CES2CES1TSHRMEN1
SCHEMBL10433278 0.87 CES1 (0.41) GRIK1CES2CES1TSHRMEN1
SCHEMBL3807703 0.86 FFAR3 (0.30) FFAR3HDAC3HDAC1HDAC2HDAC8
SCHEMBL3805922 0.86 FFAR3 (0.30) FFAR3HDAC3HDAC1HDAC2HDAC8
SCHEMBL7771392 0.85 TSHR (0.39) POLBGRIK1GRIK2TSHRKDM4E
SCHEMBL7771390 0.85 TSHR (0.39) POLBGRIK1GRIK2TSHRKDM4E
SCHEMBL27876633 0.85 TSHR (0.39) POLBGRIK1GRIK2TSHRKDM4E
SCHEMBL9618273 0.85 AKR1B1 (0.46) CES2CES1TSHRKDM4EMEN1

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 18 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-107022052-B One kind being based on N, the polycarboxylate water-reducer and its preparation method and application of N- diη-propyl maleamic acid synthesis 佛山市功能高分子材料与精细化学品专业中心 2018-11-30 CN claimed
CN-107022052-A One kind is based on N, the polycarboxylate water-reducer of N diη-propyls maleamic acid synthesis and its preparation method and application 佛山市功能高分子材料与精细化学品专业中心 2017-08-08 CN claimed
CN-115353644-A Spherical particles comprising carbon nanomaterial-graft-polyamide, method for the production thereof and use thereof 施乐公司 2022-11-18 CN disclosed
CN-115353745-A Spherical particles comprising a carbon nanomaterial graft polymer, method for the production thereof and use thereof 施乐公司 2022-11-18 CN disclosed
CN-114539765-A Compositions, methods, and articles relating to in situ crosslinking of polyamides during additive manufacturing 施乐公司 2022-05-27 CN disclosed
CN-104130358-A Preparation method for morin molecularly imprinted silica gel UNIV ANHUI SCIENCE & TECH 2014-11-05 CN disclosed
US-8597790-B2 Rubber compositions containing non-sulfur silica coupling agents bound to diene rubbers BRIDGESTONE CORPORATION (JP) 2013-12-03 US disclosed
US-20130274374-A1 RUBBER COMPOSITIONS CONTAINING NON-SULFUR SILICA COUPLING AGENTS BOUND TO DIENE RUBBERS BRIDGESTONE CORPORATION (JP) 2013-10-17 US disclosed
US-8329297-B2 Rubber compositions containing non-sulfur silica coupling agents bound to diene rubbers BRIDGESTONE CORPORATION (JP) 2012-12-11 US disclosed
US-20100132868-A1 RUBBER COMPOSITIONS CONTAINING NON-SULFUR SILICA COUPLING AGENTS BOUND TO DIENE RUBBERS BRIDGESTONE CORPORATION (JP) 2010-06-03 US disclosed
EP-1981824-A2 DISPERSION COMPRISING TITANIUM DIOXIDE AND POLYCARBOXYLATE ETHER Evonik Degussa GmbH (DE) 2008-10-22 EP disclosed
EP-1981823-A1 DISPERSION COMPRISING SILICON DIOXIDE AND POLYCARBOXYLATE ETHER Evonik Degussa GmbH (DE) 2008-10-22 EP disclosed
WO-2007088110-A2 DISPERSION COMPRISING TITANIUM DIOXIDE AND POLYCARBOXYLATE ETHER EVONIK DEGUSSA GMBH (DE) 2007-08-09 WO disclosed
WO-2007088111-A1 DISPERSION COMPRISING SILICON DIOXIDE AND POLYCARBOXYLATE ETHER EVONIK DEGUSSA GMBH (DE) 2007-08-09 WO disclosed
EP-0393713-A1 Process for the preparation of N-substituted maleimides Tosoh Corporation (JP) 1990-10-24 EP disclosed
EP-0080451-B1 METHOD AND COMPOSITION FOR DIENE RUBBER TREATMENT MONSANTO COMPANY (US) 1985-09-18 EP disclosed
US-4433114-A SULFUR OR ORGANOSULFUR COMPOUNDS, MALEAMIC ACID OR DERIVATIVES, TACKINESS, GREEN STRENGTH MONSANTO COMPANY (US) 1984-02-21 US disclosed
EP-0080451-A1 Method and composition for diene rubber treatment MONSANTO COMPANY (US) 1983-06-01 EP disclosed