SCHEMBL996780

SCHEMBL996780

CCOC1CCCCCCCCCCC1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 1/20 0.44
EPHX1 P07099 1/20 0.40
NAAA Q02083 2/20 0.36
SHBG P04278 1/20 0.36
HTT P42858 1/20 0.35
CYP1A2 P05177 1/20 0.35
ALDH1A1 P00352 3/20 0.33
CA1 P00915 2/20 0.33
CA2 P00918 2/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
ACHE P22303 1/20 0.33
KDM4E B2RXH2 2/20 0.32
CA12 O43570 1/20 0.32
CA9 Q16790 1/20 0.32
THRB P10828 1/20 0.31
ATM Q13315 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.31
CTSL P07711 1/20 0.30
CTSB P07858 1/20 0.30
CTSK P43235 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
SCHEMBL566591 1.00 NPC1 (0.44) NPC1EPHX1NAAASHBGHTT
SCHEMBL19018658 1.00 NPC1 (0.44) NPC1EPHX1NAAASHBGHTT
SCHEMBL60435 1.00
SCHEMBL5150085 1.00 NPC1 (0.44) NPC1EPHX1NAAASHBGHTT
SCHEMBL9129037 1.00 NPC1 (0.44) NPC1EPHX1NAAASHBGHTT
Charcoal, Activated SCHEMBL12484130 0.97 NPC1 (0.43) NPC1EPHX1NAAASHBGHTT
Ammonia Solution, Strong SCHEMBL8076640 0.97 NPC1 (0.43) NPC1EPHX1NAAASHBGHTT
Ammonia Solution, Strong SCHEMBL8076859 0.97 NPC1 (0.43) NPC1EPHX1NAAASHBGHTT
Ammonia Solution, Strong SCHEMBL8078526 0.97 NPC1 (0.43) NPC1EPHX1NAAASHBGHTT
SCHEMBL27265427 0.97 NPC1 (0.43) NPC1EPHX1NAAASHBGHTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115353932-A Essence composition for controlling saponification speed, application thereof and cold soap 江门市和馨香精技术有限公司 2022-11-18 CN claimed
EP-0359117-A2 Cycloalkylvinyl ethers, their production and application BASF Aktiengesellschaft (DE) 1990-03-21 EP claimed
CN-112739804-B Fabric softener compositions 塔明克私人有限公司 2024-11-12 CN disclosed
CN-115353932-A Essence composition for controlling saponification speed, application thereof and cold soap 江门市和馨香精技术有限公司 2022-11-18 CN disclosed
CN-112739804-A Fabric softener composition 塔明克公司 2021-04-30 CN disclosed
EP-3776570-A1 FRAGRANCE COMPOSITIONS AND USE THEREOF FOR IMPROVING SLEEP Takasago International Corporation (JP) 2021-02-17 EP disclosed
US-10006151-B2 Polyurethane fiber TORAY OPELONTEX CO., LTD. (JP) 2018-06-26 US disclosed
US-9975831-B2 Method for producing ether compound TAKASAGO INTERNATIONAL CORPORATION (JP) 2018-05-22 US disclosed
EP-2947185-B1 POLYURETHANE FIBER AND ITS USE TORAY OPELONTEX CO LTD (JP) 2018-02-28 EP disclosed
US-20160002827-A1 POLYURETHANE FIBER TORAY OPELONTEX CO., LTD. (JP) 2016-01-07 US disclosed
EP-2947185-A1 POLYURETHANE FIBER Toray Opelontex Co., Ltd (JP) 2015-11-25 EP disclosed
EP-1518851-A1 Process for the preparation of liquid crystalline ethers CLARIANT INTERNATIONAL LTD. (CH) 2005-03-30 EP disclosed
EP-0359117-A2 Cycloalkylvinyl ethers, their production and application BASF Aktiengesellschaft (DE) 1990-03-21 EP disclosed
EP-0073984-A2 Perfuming and/or flavouring compositions containing unsaturated acids L. GIVAUDAN & CIE Société Anonyme (CH) 1983-03-16 EP disclosed
US-4129586-A Peroxide free radical initiators containing ultraviolet light stabilizing groups PENNWALT CORPORATION (US) 1978-12-12 US disclosed
US-4055714-A POLYMERIZATION CATALYSTS PENNWALT CORPORATION (US) 1977-10-25 US disclosed
US-4045427-A POLYMERIZATION CATALYSTS PENNWALT CORPORATION (US) 1977-08-30 US disclosed
US-4045426-A POLYMERIZATION CATALYSTS PENNWALT CORPORATION (US) 1977-08-30 US disclosed
US-4042773-A REACTION WITH POLYMERS PENNWALT CORPORATION (US) 1977-08-16 US disclosed
US-3956269-A POLYMERIZATION CATALYSTS PENNWALT CORPORATION (US) 1976-05-11 US disclosed