SCHEMBL8080315

SCHEMBL8080315

[CH2]C(OCCCC)c1ccccc1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LTA4H P09960 2/20 0.44
LMNA P02545 3/20 0.41
CYP1A2 P05177 2/20 0.39
CYP2C9 P11712 1/20 0.39
CYP2C19 P33261 1/20 0.39
HTT P42858 2/20 0.39
FAAH O00519 1/20 0.38
SCN1A P35498 2/20 0.38
SCN2A Q99250 2/20 0.38
SCN3A Q9NY46 2/20 0.38
TSHR P16473 2/20 0.38
KCNH2 Q12809 2/20 0.38
TDP1 Q9NUW8 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
CHRM2 P08172 1/20 0.38
CHRM4 P08173 1/20 0.38
CHRM5 P08912 1/20 0.38
ADRA2A P08913 1/20 0.38
CYP2D6 P10635 1/20 0.38
CHRM1 P11229 1/20 0.38

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
SCHEMBL2761483 0.94 LTA4H (0.44) LTA4HLMNAHTTTSHRKCNH2
SCHEMBL16056044 0.93 NPC1 (0.44) LTA4HLMNATSHRKCNH2HTR2A
SCHEMBL2761592 0.93 NPC1 (0.44) LTA4HLMNATSHRKCNH2HTR2A
SCHEMBL2762163 0.93 NPC1 (0.44) LTA4HLMNATSHRKCNH2HTR2A
SCHEMBL6239010 0.88 LMNA (0.43) LMNACYP1A2HTTSCN1ASCN2A
SCHEMBL4953952 0.81 SCN1A (0.38) LMNACYP1A2HTTSCN1ASCN2A
SCHEMBL891208 0.81 HRH1 (0.48) CYP1A2CYP2C9CYP2C19TSHRCYP2D6
SCHEMBL9070290 0.81 LTA4H (0.44) LTA4HLMNACYP1A2CYP2C9CYP2C19
SCHEMBL10717745 0.80 LTA4H (0.47) LTA4HLMNACYP1A2CYP2C9CYP2C19
SCHEMBL1230595 0.79 L3MBTL1 (0.42) LMNACYP1A2HTTSCN1ASCN2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-108473784-B Polyfunctional polymerizable compound and coloring composition 富士胶片和光纯药株式会社 2021-01-12 CN disclosed
CN-105008407-B Process for producing propylene block copolymer 东邦钛株式会社 2018-03-06 CN disclosed
CN-106414515-A Solid catalyst component for use in polymerization of olefins, method for producing same, catalyst for use in polymerization of olefins, and method for producing olefin polymer 东邦钛株式会社 2017-02-15 CN disclosed
CN-104558403-B Crosslinking gradual change swellable polymer microballoon and preparation method thereof 中国石油化工股份有限公司 2016-09-07 CN disclosed
CN-105008407-A Process for producing propylene block copolymer TOHO TITANIUM CO LTD 2015-10-28 CN disclosed
CN-104558403-A Cross-linked gradient swelling polymeric microsphere and preparation method thereof CHINA PETROLEUM & CHEMICAL 2015-04-29 CN disclosed
CN-102319184-B Parakeratosis inhibitor, pore-shrinking agent and external composition for skin SHISEIDO CO LTD 2015-03-25 CN disclosed
CN-102319184-A Parakeratosis inhibitor, pore contracting agent and composition for external application SHISEIDO CO LTD 2012-01-18 CN disclosed
CN-101175470-B Parakeratosis inhibitor, pore-shrinking agent and external composition for skin SHISEIDO CO LTD 2011-09-14 CN disclosed
CN-101267803-B Wrinkle-improving agent SHISEIDO CO LTD 2011-06-08 CN disclosed
CN-101267803-A Wrinkle-improving agent SHISEIDO CO LTD (JP) 2008-09-17 CN disclosed
CN-101175470-A Parakeratosis inhibitor, pore-shrinking agent and external composition for skin SHISEIDO CO LTD (JP) 2008-05-07 CN disclosed
EP-0758013-B1 Liquid crystalline optical film, compensating film for liquid crystal display and liquid crystal display NIPPON OIL CO LTD (JP) 2000-10-11 EP disclosed
US-5855971-A Liquid crystalline optical film, compensating film for liquid crystal display comprising the liquid crystalline optical film, and liquid crystal display having the compensating film NIPPON OIL COMPANY, LIMITED (JP) 1999-01-05 US disclosed
EP-0758013-A1 Liquid crystalline optical film, compensating film for liquid crystal display and liquid crystal display NIPPON OIL COMPANY, LIMITED (JP) 1997-02-12 EP disclosed
EP-0369335-B1 2-Aminodecaline derivatives and their use BASF AG (DE) 1994-02-23 EP disclosed
EP-0369335-A2 2-Aminodecaline derivatives and their use BASF Aktiengesellschaft (DE) 1990-05-23 EP disclosed