SCHEMBL198177

SCHEMBL198177

C1CCC(OC2CCCCC2)CC1

nearest known ligand 0.41

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
CA1 P00915 3/20 0.41
CA2 P00918 3/20 0.41
CA12 O43570 2/20 0.39
CA9 Q16790 2/20 0.39
NPC1 O15118 1/20 0.36
EPHX1 P07099 2/20 0.35
ACHE P22303 1/20 0.35
EPHX2 P34913 1/20 0.34
ALDH1A1 P00352 2/20 0.33
HSD17B10 Q99714 1/20 0.33
CES2 O00748 1/20 0.30
CES1 P23141 1/20 0.30
CYP2C19 P33261 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
SCHEMBL9725970 1.00 CA1 (0.41) CA1CA2CA12CA9NPC1
SCHEMBL199270 1.00 CA1 (0.41) CA1CA2CA12CA9NPC1
SCHEMBL6100779 1.00 CA1 (0.41) CA1CA2CA12CA9NPC1
SCHEMBL6333537 1.00 CA1 (0.41) CA1CA2CA12CA9NPC1
SCHEMBL10775019 1.00 CA1 (0.41) CA1CA2CA12CA9NPC1
SCHEMBL5640745 1.00 CA1 (0.41) CA1CA2CA12CA9NPC1
SCHEMBL23581147 0.96 CA1 (0.39) CA1CA2CA12CA9NPC1
SCHEMBL106379 0.96 CA1 (0.39) CA1CA2CA12CA9NPC1
SCHEMBL108021 0.96 CA1 (0.39) CA1CA2CA12CA9NPC1
SCHEMBL11615689 0.96 CA1 (0.39) CA1CA2CA12CA9NPC1

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

Appears in 2681 patents — a generic fragment claimed broadly, so it's down-weighted as IP noise. Top by claim status then date:

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20260051540-A1 ELECTROLYTE COMPOSITIONS INCLUDING QUATERNARY AMMONIUM COMPOUNDS FOR SECONDARY BATTERIES GEORGIA TECH RESEARCH CORPORATION (US) 2026-02-19 US claimed
EP-3848370-B1 TYK2 INHIBITORS AND USES THEREOF TAKEDA PHARMACEUTICALS CO (JP) 2025-05-07 EP claimed
CN-116573981-B Resolution method of beta receptor blocker raceme medicine 中南大学 2025-05-06 CN claimed
US-12252576-B2 Process and catalyst composition for producing linear alpha olefins in high yield by ethylene oligomerization INDIAN OIL CORPORATION LIMITED (IN) 2025-03-18 US claimed
CN-119504654-A Synthesis method and application of hexafluoropropylene oxide 中化蓝天氟材料有限公司 2025-02-25 CN claimed
WO-2025034849-A1 FUSED PYRIDAZINES FOR THE TREATMENT OF CANCER AND OTHER INDICATIONS THERAS, INC. (US) 2025-02-13 WO claimed
CN-110981873-B Preparation method for synthesizing pyrroloquinoline quinone by five-step method 江西农业大学 2025-01-24 CN claimed
CN-119247698-A Liquid metal photoresist composition, preparation method, patterning method and application 北京大学 2025-01-03 CN claimed
WO-2024192144-A1 PYRAZOLOPYRIMIDINES AS ANTIDOTES FOR ARSENICALS SOUTHERN RESEARCH INSTITUTE (US) 2024-09-19 WO claimed
CN-111755710-B Lithium primary battery electrolyte and preparation method and application thereof 北京卫蓝新能源科技有限公司 2024-08-30 CN claimed
EP-0106218-B1 BLOCK COPOLYMERS AND PROCESS FOR THEIR PREPARATION The B.F. GOODRICH Company (US) 1986-03-19 EP claimed
EP-0162908-A1 PREPARATION OF ALKALINE EARTH METAL ORGANOMETALLIC COMPOUNDS LITHIUM CORPORATION OF AMERICA (US) 1985-12-04 EP claimed
US-4555498-A Preparation of certain alkaline earth metal organometallic compounds LITHIUM CORPORATION OF AMERICA (US) 1985-11-26 US claimed
WO-1985002176-A1 PREPARATION OF ALKALINE EARTH METAL ORGANOMETALLIC COMPOUNDS LITHIUM CORPORATION OF AMERICA (US) 1985-05-23 WO claimed
US-4499305-A FORMING STABLE DISPERSIONS OF A TRANSITION METAL COMPLEX AND 1,3-BIS/2-PYRIDYLIMINO/ISOINDOLINE IN CYCLOHEXANOL, CYCLOHEXANONE AND/OR CYCLOHEXANE E. I. DU PONT DE NEMOURS AND COMPANY (US) 1985-02-12 US claimed
US-4273905-A CATALYST SUMITOMO CHEMICAL CO., LTD. (JP) 1981-06-16 US claimed
US-4163747-A Process for the preparation of 1-alkylamino-anthraquinones BAYER AKTIENGESELLSCHAFT (DE) 1979-08-07 US claimed
US-4086229-A Dinitrosyldihalo complexes of molybdenum or tungsten PHILLIPS PETROLEUM COMPANY (US) 1978-04-25 US claimed
US-4018688-A Capsules, process of their preparation and fabric conditioning composition containing said capsules THE PROCTER & GAMBLE COMPANY (US) 1977-04-19 US claimed
US-3960765-A REDUCING TITANIUM TETRACHLORIDE WITH AN ORGANOALUMINUM COMPOUND, COMPLEXING AGENT SUMITOMO CHEMICAL COMPANY, LIMITED (JA) 1976-06-01 US claimed