SCHEMBL57607

SCHEMBL57607

CCCCc1c[c]ccc1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA2 P00918 2/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
TDP1 Q9NUW8 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
CA1 P00915 1/20 0.38
ALDH1A1 P00352 2/20 0.37
HPGD P15428 2/20 0.37
HSD17B10 Q99714 2/20 0.37
LPL P06858 2/20 0.37
LIPG Q9Y5X9 2/20 0.37
KCNH2 Q12809 1/20 0.37
SIGMAR1 Q99720 1/20 0.36
SKP2 Q13309 1/20 0.36
XIAP P98170 1/20 0.36
CNR2 P34972 1/20 0.36
ESR1 P03372 2/20 0.35
ADRA2A P08913 2/20 0.35
ADORA3 P0DMS8 2/20 0.35
TACR2 P21452 2/20 0.35
SLC6A2 P23975 2/20 0.35

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
SCHEMBL278144 0.94 TDP1 (0.47) CA2TDP1L3MBTL1ALDH1A1HSD17B10
SCHEMBL10602889 0.92 KCNH2 (0.46) TDP1L3MBTL1ALDH1A1HSD17B10LPL
SCHEMBL828059 0.92 KCNH2 (0.46) TDP1L3MBTL1ALDH1A1HSD17B10LPL
SCHEMBL4208084 0.92 KCNH2 (0.46) TDP1L3MBTL1ALDH1A1HSD17B10LPL
SCHEMBL4865067 0.92 KCNH2 (0.46) TDP1L3MBTL1ALDH1A1HSD17B10LPL
SCHEMBL5207581 0.92 KCNH2 (0.46) TDP1L3MBTL1ALDH1A1HSD17B10LPL
SCHEMBL533252 0.92 KCNH2 (0.46) TDP1L3MBTL1ALDH1A1HSD17B10LPL
SCHEMBL263493 0.92 KCNH2 (0.46) TDP1L3MBTL1ALDH1A1HSD17B10LPL
SCHEMBL20774553 0.92 KCNH2 (0.46) TDP1L3MBTL1ALDH1A1HSD17B10LPL
SCHEMBL5209751 0.92 KCNH2 (0.46) TDP1L3MBTL1ALDH1A1HSD17B10LPL

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 1479 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116970107-A Catalyst combination and method for preparing poly alpha-olefin synthetic oil by using same 万华化学集团股份有限公司 2023-10-31 CN claimed
CN-115124474-A N-heterocyclic structure-containing andrographolide derivative and preparation method and application thereof 郑州大学 2022-09-30 CN claimed
CN-114867495-A Prophylactic and/or therapeutic agent for chronic prostatitis/chronic pelvic pain syndrome 日本新药株式会社 2022-08-05 CN claimed
CN-114845735-A Antitumor drug combined with immune checkpoint inhibitor 日本新药株式会社 2022-08-02 CN claimed
CN-112225685-B 3-cyanoindole compound, preparation method and application thereof 温州大学 2022-04-08 CN claimed
CN-113004532-A Metamaterial based on covalent organic framework and application of metamaterial in optical device 浙江大学 2021-06-22 CN claimed
CN-112225685-A 3-cyanoindole compound, preparation method and application thereof 温州大学 2021-01-15 CN claimed
CN-106232120-B Process for preparing N-benzyl-3-hydroxy-4-substituted-pyridin-2- (1H) -ones 爱尔皮奥治疗有限公司 2021-01-08 CN claimed
CN-111100045-A Synthetic method of alkenyl sulfone compound 中国科学技术大学 2020-05-05 CN claimed
CN-106554325-B A kind of preparation method of chirality benzene sulfinyl aminated compounds 上海交通大学 2019-02-22 CN claimed
EP-1189905-A1 SUBSTITUTED HETEROCYCLE FUSED GAMMA-CARBOLINES Bristol-Myers Squibb Pharma Company (US) 2002-03-27 EP claimed
EP-1189904-A1 SUBSTITUTED HETEROCYCLE FUSED GAMMA-CARBOLINES Bristol-Myers Squibb Pharma Company (US) 2002-03-27 EP claimed
WO-2000077010-A2 SUBSTITUTED HETEROCYCLE FUSED GAMMA-CARBOLINES DU PONT PHARMACEUTICALS COMPANY (US) 2000-12-21 WO claimed
WO-2000077002-A1 SUBSTITUTED HETEROCYCLE FUSED GAMMA-CARBOLINES DU PONT PHARMACEUTICALS COMPANY (US) 2000-12-21 WO claimed
WO-2000077001-A1 SUBSTITUTED HETEROCYCLE FUSED GAMMA-CARBOLINES DU PONT PHARMACEUTICALS COMPANY (US) 2000-12-21 WO claimed
EP-0885890-A1 SULFONYLUREIDOPYRAZOLE DERIVATIVES SUMITOMO PHARMACEUTICALS COMPANY, LIMITED (JP) 1998-12-23 EP claimed
US-5773388-A Pyrimidine derivatives, herbicides and plant growth regulators NISSAN CHEMICAL INDUSTRIES, LTD. (JP) 1998-06-30 US claimed
US-5206149-A Reaction of peroxidase, oxidant, luminol and 2-hydroxy-9-fluorenone enhancer; chemiluminescence TORAY INDUSTRIES, INC. (JP) 1993-04-27 US claimed
EP-0059291-B1 ANTIHYPERTENSIVE AGENTS AMERICAN HOME PRODUCTS CORPORATION (US) 1985-03-27 EP claimed
EP-0134515-A1 Azolyl-propane nitriles, method for the preparation of these compounds and biocide agents containing them SCHERING AKTIENGESELLSCHAFT (DE) 1985-03-20 EP claimed