SCHEMBL222

SCHEMBL222

N#Cc1ccccc1-c1ccccc1C#N

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ESR2 Q92731 1/20 0.60
TSHR P16473 3/20 0.55
USP8 P40818 1/20 0.48
USP7 Q93009 1/20 0.48
GABRG2 P18507 1/20 0.46
GABRB3 P28472 1/20 0.46
GABRA5 P31644 1/20 0.46
GABRA3 P34903 1/20 0.46
PTPN5 P54829 1/20 0.44
CA1 P00915 1/20 0.43
CA2 P00918 1/20 0.43
TRPA1 O75762 1/20 0.43
PTGES O14684 1/20 0.42
CYP1A2 P05177 1/20 0.41
CYP3A4 P08684 1/20 0.41
CYP2C9 P11712 1/20 0.41
CYP2C19 P33261 1/20 0.41
PDK2 Q15119 1/20 0.41
MCL1 Q07820 1/20 0.41
ALDH1A1 P00352 1/20 0.40

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
SCHEMBL29412287 1.00 ESR2 (0.60) ESR2TSHRUSP8USP7GABRG2
SCHEMBL12679722 0.87 ESR2 (0.50) ESR2TSHRUSP8USP7GABRG2
Bicarbonate SCHEMBL7256331 0.87 ESR2 (0.55) ESR2TSHRUSP8USP7GABRG2
SCHEMBL19579052 0.85 ESR2 (0.48) ESR2TSHRUSP8USP7GABRG2
SCHEMBL1472952 0.85 TSHR (0.67) ESR2TSHRUSP8USP7ALDH1A1
SCHEMBL1285853 0.85 ESR2 (0.59) ESR2TSHRUSP8USP7GABRG2
SCHEMBL17266575 0.85 LRRK2 (0.49) ESR2TSHRALDH1A1HTTKDM4E
SCHEMBL565467 0.85 ESR2 (0.59) ESR2TSHRUSP8USP7GABRG2
SCHEMBL17712501 0.85 ESR2 (0.48) ESR2TSHRUSP8USP7GABRG2
SCHEMBL11876478 0.85 ESR2 (0.48) ESR2TSHRUSP8USP7GABRG2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-122011587-A Dynamic crosslinked polypropylene cable insulating material with thermo-mechanical stability and preparation method thereof 国网陕西省电力有限公司电力科学研究院 2026-05-12 CN claimed
CN-117720437-A Negative dispersion optical film and compound 山东和桐新材料有限公司 2024-03-19 CN claimed
CN-115894882-B Liquid crystal polymer containing sulfur ether with excellent performance and preparation method thereof 常州瑞杰新材料科技有限公司 2024-02-27 CN claimed
CN-114560790-B Biphenyl-2-nitrile compound and preparation method thereof 赣南师范大学 2024-02-20 CN claimed
US-20240006613-A1 POROUS SOLID COMPOUND, METHOD FOR PREPARING SAME, CATHODE FOR LITHIUM SECONDARY BATTERY COMPRISING POROUS SOLID COMPOUND, AND LITHIUM SECONDARY BATTERY LG Energy Solution, LTD (KR) 2024-01-04 US claimed
EP-4219481-A1 POROUS SOLID COMPOUND, METHOD FOR PREPARING SAME, CATHODE FOR LITHIUM SECONDARY BATTERY COMPRISING POROUS SOLID COMPOUND, AND LITHIUM SECONDARY BATTERY LG Energy Solution, Ltd. (KR) 2023-08-02 EP claimed
CN-116457341-A Porous solid compound, method for producing same, positive electrode for lithium secondary battery comprising porous solid compound, and lithium secondary battery 株式会社LG新能源 2023-07-18 CN claimed
CN-116088214-A Polymer dispersed liquid crystal device and preparation method thereof 苏州科技大学 2023-05-09 CN claimed
US-11628418-B1 PSA-functionalized sol-gel sorbent materials and methods of preparation THE FLORIDA INTERNATIONAL UNIVERSITY BOARD OF TRUSTEES (US) 2023-04-18 US claimed
CN-115894882-A Thioether-containing liquid crystal polymer with excellent performance and preparation method thereof 常州瑞杰新材料科技有限公司 2023-04-04 CN claimed
US-20050106068-A1 Sol-gel dendron separation and extraction capillary column UNIVERSITY OF SOUTH FLORIDA 2005-05-19 US claimed
WO-2005033063-A2 MELANIN CONCENTRATING HORMONE ANTAGONISTS THE PROCTER & GAMBLE COMPANY (US) 2005-04-14 WO claimed
US-20040129141-A1 High efficiency sol-gel gas chromatography column UNIVERSITY OF SOUTH FLORIDA 2004-07-08 US claimed
EP-1102738-B1 METHOD FOR THE ACIDIC OR ALKALINE SAPONIFICATION OF BIPHENYL NITRILES LEHMANN BERND DR (DE) 2002-12-04 EP claimed
WO-2002094410-A1 SOL-GEL DENDRON SEPARATION AND EXTRACTION CAPILLARY COLUMN UNIVERSITY OF SOUTH FLORIDA (US) 2002-11-28 WO claimed
WO-2002072225-A1 HIGH EFFICIENCY SOL-GEL GAS CHROMATOGRAPHY COLUMN UNIVERSITY OF SOUTH FLORIDA (US) 2002-09-19 WO claimed
EP-1102738-A1 METHOD FOR THE ACIDIC OR ALKALINE SAPONIFICATION OF BIPHENYL NITRILES Great Lakes Chemical Konstanz GmbH (DE) 2001-05-30 EP claimed
WO-2000003964-A1 METHOD FOR THE ACIDIC OR ALKALINE SAPONIFICATION OF BIPHENYL NITRILES GREAT LAKES CHEMICAL KONSTANZ GMBH (DE) 2000-01-27 WO claimed
WO-1994007872-A1 PROCESS FOR THE PREPARATION OF TETRAZOLES ABBOTT LABORATORIES (US) 1994-04-14 WO claimed
US-5284954-A Process for the preparation of tetrazoles ABBOTT LABORATORIES (US) 1994-02-08 US claimed