SCHEMBL1725487

SCHEMBL1725487

CC(C)c1cccc2c1[nH]c1ccccc12

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KIF11 P52732 7/20 0.58
ALDH1A1 P00352 3/20 0.48
HSD17B10 Q99714 3/20 0.48
GPR3 P46089 1/20 0.48
MAPT P10636 3/20 0.47
GABRP O00591 2/20 0.47
GABRD O14764 2/20 0.47
GABRA1 P14867 2/20 0.47
GABRB1 P18505 2/20 0.47
GABRG2 P18507 2/20 0.47
GABRB3 P28472 2/20 0.47
GABRA5 P31644 2/20 0.47
GABRA3 P34903 2/20 0.47
GABRA2 P47869 2/20 0.47
GABRB2 P47870 2/20 0.47
GABRA4 P48169 2/20 0.47
GABRE P78334 2/20 0.47
GABRA6 Q16445 2/20 0.47
GABRG1 Q8N1C3 2/20 0.47
GABRG3 Q99928 2/20 0.47

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
SCHEMBL27339103 0.86 GABRA1 (0.46) KIF11GABRA1GABRB1GABRG2GABRB3
SCHEMBL6053190 0.85 KIF11 (0.55) KIF11ALDH1A1HSD17B10GPR3MAPT
SCHEMBL9654574 0.85 KIF11 (0.55) KIF11ALDH1A1HSD17B10GPR3MAPT
SCHEMBL195189 0.85 KIF11 (0.55) KIF11ALDH1A1HSD17B10GPR3MAPT
SCHEMBL10662808 0.84 KIF11 (0.57) KIF11ALDH1A1HSD17B10GPR3MAPT
SCHEMBL28422269 0.84 MAPT (0.44) KIF11ALDH1A1MAPTMEN1KMT2A
SCHEMBL5150446 0.82 KIF11 (0.55) KIF11ALDH1A1HSD17B10GPR3MAPT
SCHEMBL28155368 0.82 KIF11 (0.51) KIF11ALDH1A1HSD17B10GPR3MAPT
Ethylene SCHEMBL28301101 0.82 KIF11 (0.41) KIF11ALDH1A1HSD17B10GPR3MAPT
SCHEMBL1306037 0.81 KIF11 (0.50) KIF11ALDH1A1HSD17B10GPR3MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-109353987-A A kind of liquid hydrogen storage material and preparation method thereof 汽解放汽车有限公司 2019-02-19 CN claimed
CN-109126658-A A kind of micro passage reaction and its method of dehydrogenating of the dehydrogenation reaction suitable for liquid hydrogen source material 北京国能中林科技开发有限公司 2019-01-04 CN claimed
CN-108530465-A A kind of information-recording material and preparation method thereof of visible light sensitivity 北京化工大学 2018-09-14 CN claimed
CN-108067172-A The micro passage reaction and method of dehydrogenating of a kind of dehydrogenation reaction suitable for liquid hydrogen source material 北京国能中林科技开发有限公司 2018-05-25 CN claimed
CN-106985688-A Battery status monitoring system and method for electric automobile 浙江农业商贸职业学院 2017-07-28 CN claimed
CN-106926724-A Electric automobile charging station and charging electric vehicle method based on regenerative resource 浙江农业商贸职业学院 2017-07-07 CN claimed
CN-104555914-B Liquid hydrogen storage system 江苏氢阳能源有限公司 2017-06-13 CN claimed
EP-1660404-A2 HYDROGEN STORAGE REVERSIBLE HYDROGENATED OF PI-CONJUGATED SUBSTRATES AIR PRODUCTS AND CHEMICALS, INC. (US) 2006-05-31 EP claimed
WO-2005000457-A2 HYDROGEN STORAGE REVERSIBLE HYDROGENATED OF PI-CONJUGATED SUBSTRATES AIR PRODUCTS AND CHEMICALS, INC. (US) 2005-01-06 WO claimed
CN-117024450-A Carbene money metal complex and preparation and application thereof 武汉大学 2023-11-10 CN disclosed
CN-114735643-B Organic liquid hydrogen storage material, performance regulation and control method and application thereof 瀚锐氢能科技集团有限公司 2023-10-27 CN disclosed
CN-114735643-A Organic liquid hydrogen storage material and performance regulation method and application thereof 北京瀚锐氢能科技有限公司 2022-07-12 CN disclosed
CN-109553606-B General formula compound and organic light-emitting device 北京鼎材科技有限公司 2021-02-19 CN disclosed
CN-108530465-B Visible light sensitive information recording material and preparation method thereof 北京化工大学 2020-06-05 CN disclosed
US-5637432-A Toner for developing electrostatic image comprising titanium oxide particles CANON KABUSHIKI KAISHA (JP) 1997-06-10 US disclosed
EP-0411192-A1 Electrophotographic photoreceptor IDEMITSU KOSAN COMPANY LIMITED (JP) 1991-02-06 EP disclosed
US-4833053-A Photoconductive devices containing squarilium dye compositions RICOH CORPORATION (US) 1989-05-23 US disclosed
US-4500621-A Sensitive electrophotographic plates containing squaric acid methine dyes suspended in a binder RICOH SYSTEMS, INC. (US) 1985-02-19 US disclosed
US-4481270-A Photoreceptor containing squaric acid methine dyes RICOH SYSTEMS, INC. (US) 1984-11-06 US disclosed
US-4052210-A BISAZO NAPHTHOL OCE-VAN DER GRINTEN N.V. (NL) 1977-10-04 US disclosed