SCHEMBL95988

SCHEMBL95988

OCCSc1ccccc1

nearest known ligand 0.70

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.70
MAPK1 P28482 2/20 0.70
MEN1 O00255 3/20 0.55
KMT2A Q03164 3/20 0.55
FFAR1 O14842 1/20 0.50
CA12 O43570 1/20 0.50
CA1 P00915 1/20 0.50
CA2 P00918 1/20 0.50
CA7 P43166 1/20 0.50
CA13 Q8N1Q1 1/20 0.50
CYP1A2 P05177 3/20 0.48
CYP3A4 P08684 3/20 0.48
CYP2D6 P10635 3/20 0.48
CYP2C19 P33261 3/20 0.48
MTNR1A P48039 1/20 0.48
MTNR1B P49286 1/20 0.48
RAB9A P51151 5/20 0.48
NPC1 O15118 4/20 0.48
SMN1; SMN2 Q16637 4/20 0.48
CDC25A P30304 3/20 0.48

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
SCHEMBL8637757 0.86 CA2 (0.61) ALDH1A1MAPK1MEN1KMT2ACA12
SCHEMBL95857 0.85 ALDH1A1 (0.64) ALDH1A1MAPK1MEN1KMT2AFFAR1
Acrylic Acid SCHEMBL28466890 0.84 ALDH1A1 (0.50) ALDH1A1MAPK1MEN1KMT2AFFAR1
SCHEMBL96807 0.83 ALDH1A1 (0.61) ALDH1A1MAPK1MEN1KMT2AFFAR1
SCHEMBL776647 0.83 ALDH1A1 (1.00) ALDH1A1MAPK1MEN1KMT2AFFAR1
SCHEMBL10035840 0.82 ALDH1A1 (0.46) ALDH1A1MAPK1MEN1KMT2ACA12
SCHEMBL23014948 0.81 ALDH1A1 (0.58) ALDH1A1MAPK1MEN1KMT2AFFAR1
SCHEMBL97656 0.81 ALDH1A1 (0.58) ALDH1A1MAPK1MEN1KMT2AFFAR1
SCHEMBL95506 0.81 ALDH1A1 (0.58) ALDH1A1MAPK1MEN1KMT2AFFAR1
SCHEMBL30194885 0.81 ALDH1A1 (0.46) ALDH1A1MAPK1MEN1KMT2AFFAR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118374255-A Double-component solvent-free ultraviolet aging resistant polyurethane adhesive, preparation method thereof and polyurethane product 万华化学(北京)有限公司 2024-07-23 CN claimed
CN-117089285-A Automobile tail lamp repairing method 李永均 2023-11-21 CN claimed
CN-115557836-A Preparation method of carboxylic acid 云南大学 2023-01-03 CN claimed
CN-113429324-A Photoresist acid-producing resin monomer and synthesis method and application thereof 徐州博康信息化学品有限公司 2021-09-24 CN claimed
CN-112920099-A Photoacid generator with diphenyl sulfonium structure and synthesis method thereof 华衍化学(上海)有限公司 2021-06-08 CN claimed
CN-109852800-B Extracting agent for recovering industrial waste palladium catalyst and palladium recovery method 河南能源化工集团研究总院有限公司 2020-11-03 CN claimed
US-9293711-B2 Organic semiconductor formulations POLYERA CORPORATION (US) 2016-03-22 US claimed
EP-2748143-A1 MONOMERIC AND OLIGOMERIC UNSATURATED VICINAL DITHIOETHERS AND THEIR USE FOR SELECTIVE PALLADIUM (II) SEPARATION FROM SECONDARY RAW MATERIALS Universität Potsdam (DE) 2014-07-02 EP claimed
US-20140042369-A1 Organic Semiconductor Formulations USINVEST LLC 2014-02-13 US claimed
US-8431673-B2 Radiation curable compositions CYTEC SURFACE SPECIALTIES S.A. (BE) 2013-04-30 US claimed
EP-0493529-B1 YTTRIUM AND RARE EARTH COMPOUNDS CATALYZED LACTONE POLYMERIZATION DU PONT (US) 1995-07-05 EP claimed
US-5270311-A [1,2,4]-Triazolo[1,5-a]and pyrazolo[2,3-a][1,3,5]triazine derivatives IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1993-12-14 US claimed
EP-0493529-A1 YTTRIUM AND RARE EARTH COMPOUNDS CATALYZED LACTONE POLYMERIZATION. DU PONT (US) 1992-07-08 EP claimed
EP-0488345-A1 1,4-Dihydropyridine derivatives and methods of producing the same FUJIREBIO INC. (JP) 1992-06-03 EP claimed
EP-0459702-A1 Azole Derivatives ZENECA LIMITED (GB) 1991-12-04 EP claimed
US-5028667-A Biodegradable Polymers For Medical Uses And Flexible Films For Packaging E.I. DU PONT DE NEMOURS AND COMPANY (US) 1991-07-02 US claimed
WO-1991005001-A1 YTTRIUM AND RARE EARTH COMPOUNDS CATALYZED LACTONE POLYMERIZATION E.I. DU PONT DE NEMOURS AND COMPANY (US) 1991-04-18 WO claimed
EP-0202054-B1 PRODUCTION OF S-ARYL S-ALKYL DITHIOCARBONATES, ARENETHIOLS AND ARYTHIOETHERS COURTAULDS PLC (GB) 1990-07-25 EP claimed
EP-0202054-A1 Production of S-aryl S-alkyl dithiocarbonates, arenethiols and arythioethers COURTAULDS PLC (GB) 1986-11-20 EP claimed
US-4559109-A MULTISTAGE SOLVENT EXTRACTION PHILLIPS PETROLEUM COMPANY (US) 1985-12-17 US claimed