SCHEMBL1997659

SCHEMBL1997659

N#Cc1coc(C#N)c1C#N

nearest known ligand 0.38

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.31
ALDH1A1 P00352 2/20 0.31
POLB P06746 1/20 0.31
KMT2A Q03164 1/20 0.31
TDP1 Q9NUW8 1/20 0.31
ALOX15 P16050 1/20 0.31
HSD17B10 Q99714 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.30
HIF1A Q16665 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
Fluoride SCHEMBL30644920 0.98 TSHR (0.30) TSHRALDH1A1POLBKMT2ATDP1
Phenol SCHEMBL28053399 0.83 ESR2 (0.43) TSHRALDH1A1KMT2ATDP1ALOX15
SCHEMBL27960914 0.69
SCHEMBL1004105 0.62
SCHEMBL645262 0.61 TSHR (0.48) TSHRALDH1A1KMT2ASMN1; SMN2HIF1A
SCHEMBL5150695 0.60
SCHEMBL29732945 0.60
SCHEMBL5490887 0.60
SCHEMBL9835277 0.60 ALDH1A1 (0.33) ALDH1A1KMT2AALOX15HSD17B10SMN1; SMN2
SCHEMBL152358 0.60 TSHR (0.39) TSHRALDH1A1KMT2ASMN1; SMN2HIF1A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-119799029-A Novel supermolecule cyanine dye contrast agent for enhancing optoacoustic, preparation method and application thereof 深圳大学 2025-04-11 CN claimed
CN-111868612-B Polycarbonate having electro-optical effect, method for producing same, and light control element using same 帝人株式会社 2025-04-01 CN claimed
CN-119462597-A Specific chemiluminescent probe for measuring CYP3A, preparation method and application thereof 遵义医科大学 2025-02-18 CN claimed
CN-118908921-A Anionic pentamethine cyanine and preparation method and application thereof 华中科技大学 2024-11-08 CN claimed
CN-118221619-A Synthesis of D-pi-A type organic conjugated molecule and application of D-pi-A type organic conjugated molecule in detection of water content in organic solvent 成都师范学院 2024-06-21 CN claimed
CN-117546087-A Removal of carbon from seawater and other liquids using photoactive compounds 华盛顿大学 2024-02-09 CN claimed
CN-116987267-A Fluorinated polyurethane imide-polyimide copolymer electro-optic waveguide material 淮南师范学院 2023-11-03 CN claimed
CN-116719181-A Grating type electro-optic adjustable filter with waveguide structure directly formed by metal bottom electrode 长春市华信科瑞光电技术有限公司 2023-09-08 CN claimed
CN-116617389-A Application of aggregation-induced photodegradable and I/II type photosensitive molecules 川北医学院 2023-08-22 CN claimed
CN-114516865-B D-pi-A type organic conjugated molecule, and preparation method and application thereof 成都师范学院 2023-06-23 CN claimed
US-20150267031-A1 POLYMERS FUNCTIONALIZED WITH HETEROCYCLIC NITRILE COMPOUNDS BRIDGESTONE CORPORATION (JP) 2015-09-24 US claimed
US-9085646-B2 Polymers functionalized with heterocyclic nitrile compounds BRIDGESTONE CORPORATION (JP) 2015-07-21 US claimed
US-20130066016-A1 POLYMERS FUNCTIONALIZED WITH HETEROCYCLIC NITRILE COMPOUNDS BRIDGESTONE CORPORATION (JP) 2013-03-14 US claimed
US-8362156-B2 Polymers functionalized with heterocyclic nitrile compounds BRIDGESTONE CORPORATION (JP) 2013-01-29 US claimed
US-8314189-B2 Polymers functionalized with heterocyclic nitrile compounds BRIDGESTONE CORPORATION (JP) 2012-11-20 US claimed
US-20100280217-A1 POLYMERS FUNCTIONALIZED WITH HETEROCYCLIC NITRILE COMPOUNDS BRIDGESTONE CORPORATION (JP) 2010-11-04 US claimed
EP-2203482-A1 POLYMERS FUNCTIONALIZED WITH HETEROCYCLIC NITRILE COMPOUNDS Bridgestone Corporation (JP) 2010-07-07 EP claimed
WO-2009051700-A1 POLYMERS FUNCTIONALIZED WITH HETEROCYCLIC NITRILE COMPOUNDS BRIDGESTONE CORPORATION (US) 2009-04-23 WO claimed
WO-2009051702-A1 POLYMERS FUNCTIONALIZED WITH HETEROCYCLIC NITRILE COMPOUNDS BRIDGESTONE CORPORATION (JP) 2009-04-23 WO claimed
US-20090099325-A1 POLYMERS FUNCTIONALIZED WITH HETEROCYCLIC NITRILE COMPOUNDS BRIDGESTONE CORPORATION 2009-04-16 US claimed