SCHEMBL11117624

SCHEMBL11117624

Cc1c(C)c2ccc3cccc4ccc(c1C)c2c34

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HPGD P15428 5/20 0.60
TSHR P16473 5/20 0.60
ALDH1A1 P00352 5/20 0.60
HSD17B10 Q99714 4/20 0.60
CYP3A4 P08684 4/20 0.60
L3MBTL1 Q9Y468 2/20 0.60
TDP1 Q9NUW8 1/20 0.60
CYP1A2 P05177 6/20 0.55
CYP1A1 P04798 2/20 0.55
CYP1B1 Q16678 2/20 0.55
MAPK1 P28482 1/20 0.50
CASP1 P29466 1/20 0.50
RAB9A P51151 1/20 0.50
CASP7 P55210 1/20 0.50
ATM Q13315 1/20 0.50
HIF1A Q16665 1/20 0.50
ERBB2 P04626 1/20 0.45
FYN P06241 1/20 0.45
MAOA P21397 1/20 0.45
ACHE P22303 1/20 0.45

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
SCHEMBL28540810 0.98 HPGD (0.58) HPGDTSHRALDH1A1HSD17B10CYP3A4
Benzo[E]Pyrene SCHEMBL29136104 0.89 ALDH1A1 (0.64) HPGDTSHRALDH1A1HSD17B10CYP3A4
SCHEMBL27895183 0.85 HPGD (0.50) HPGDTSHRALDH1A1HSD17B10CYP3A4
SCHEMBL19511926 0.85 HPGD (0.50) HPGDTSHRALDH1A1HSD17B10CYP3A4
SCHEMBL28254692 0.82 HPGD (0.52) HPGDTSHRALDH1A1HSD17B10CYP3A4
SCHEMBL598697 0.82 HSD17B10 (0.64) HPGDTSHRALDH1A1HSD17B10CYP3A4
SCHEMBL31414281 0.82 ALDH1A1 (0.52) HPGDTSHRALDH1A1HSD17B10CYP3A4
SCHEMBL27533493 0.82 ALDH1A1 (0.52) HPGDTSHRALDH1A1HSD17B10CYP3A4
SCHEMBL2539042 0.81 ALDH1A1 (0.73) HPGDTSHRALDH1A1HSD17B10CYP3A4
SCHEMBL713316 0.81 ALDH1A1 (0.73) HPGDTSHRALDH1A1HSD17B10CYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117810564-A Functional material, preparation method thereof, negative plate and battery 惠州亿纬动力电池有限公司 2024-04-02 CN claimed
CN-117393705-A Chemical prelithiation method for preparing organic anode material with high first coulombic efficiency 重庆理工大学 2024-01-12 CN claimed
CN-117810564-A Functional material, preparation method thereof, negative plate and battery 惠州亿纬动力电池有限公司 2024-04-02 CN disclosed
CN-117393705-A Chemical prelithiation method for preparing organic anode material with high first coulombic efficiency 重庆理工大学 2024-01-12 CN disclosed
CN-117280015-A Mesophase pitch compositions from aromatic feedstocks, methods of making and uses thereof 埃克森美孚化学专利公司 2023-12-22 CN disclosed
CN-108008600-B Radiation-sensitive composition 三菱瓦斯化学株式会社 2021-02-09 CN disclosed
US-4426327-A PIGMENTS IN ELECTROGRAPHY RICOH CO., LTD. (JP) 1984-01-17 US disclosed
US-4293628-A Electrophotographic elements containing disazo compounds RICOH CO., LTD. (JP) 1981-10-06 US disclosed
US-4016135-A STABILIZATION OF A POLYMERIC RESIN WITH AN ALKYL SUBSTITUTED TETRACYCLIC COMPOUND KUREHA KAGAKU KOGYO KABUSHIKI KAISHA (JA) 1977-04-05 US disclosed