SCHEMBL51950

SCHEMBL51950

CCC(CC1CO1)c1ccccc1

nearest known ligand 0.55

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
TAAR1 Q96RJ0 4/20 0.55
CYP2D6 P10635 1/20 0.55
CHRM2 P08172 3/20 0.42
CHRM4 P08173 3/20 0.42
CHRM5 P08912 3/20 0.42
CHRM1 P11229 3/20 0.42
CHRM3 P20309 3/20 0.42
LMNA P02545 1/20 0.39
TDP1 Q9NUW8 1/20 0.39
CCR5 P51681 1/20 0.38
APOBEC3A P31941 1/20 0.37
KMT2A Q03164 1/20 0.37
CTDSP1 Q9GZU7 1/20 0.37
APOBEC3G Q9HC16 1/20 0.37
ALDH1A1 P00352 1/20 0.36
GLA P06280 1/20 0.36

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
SCHEMBL3117376 0.88 TDP1 (0.44) TAAR1CYP2D6CHRM2CHRM4CHRM5
SCHEMBL23501585 0.80 TAAR1 (0.45) TAAR1CYP2D6LMNATDP1ALDH1A1
SCHEMBL5495958 0.78 TDP1 (0.45) TAAR1CYP2D6CHRM2CHRM4CHRM5
SCHEMBL11880664 0.77 GABBR2 (0.54) CYP2D6LMNAKMT2AALDH1A1
SCHEMBL52157 0.77 TAAR1 (0.53) TAAR1CHRM2CHRM4CHRM5CHRM1
SCHEMBL169508 0.75 LMNA (0.56) TAAR1CYP2D6LMNATDP1CCR5
Hydrochloric Acid SCHEMBL19405689 0.75 TDP1 (0.42) TAAR1CYP2D6CHRM2CHRM4CHRM5
SCHEMBL3415655 0.75 ALDH1A1 (0.41) TAAR1CYP2D6CHRM2CHRM4CHRM5
SCHEMBL18531113 0.74 TDP1 (0.43) TAAR1CHRM2CHRM4CHRM5CHRM1
SCHEMBL20125070 0.74 TDP1 (0.43) TAAR1CHRM2CHRM4CHRM5CHRM1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118005827-A Photopolymerization initiator 科巨希化学股份有限公司 2024-05-10 CN disclosed
CN-114929757-B Photopolymerization initiator 科巨希化学股份有限公司 2024-02-20 CN disclosed
CN-114929757-A Photopolymerization initiator 科巨希化学股份有限公司 2022-08-19 CN disclosed
CN-109535707-B Pneumatic tire 横滨橡胶株式会社 2021-05-25 CN disclosed
CN-107078352-B Nonaqueous electrolyte solution and nonaqueous electrolyte secondary battery using same 三菱化学株式会社 2020-04-28 CN disclosed
EP-2508342-B1 INNER LINER FOR PNEUMATIC TIRE, AND METHOD FOR PRODUCING SAME KURARAY CO (JP) 2020-04-01 EP disclosed
EP-2508343-B1 MULTILAYER STRUCTURE AND METHOD FOR PRODUCING SAME KURARAY CO (JP) 2020-03-11 EP disclosed
EP-2554372-B1 MULTILAYERED STRUCTURE AND LAMINATE AND METHOD FOR PRODUCTION OF THE SAME KURARAY CO (JP) 2020-01-08 EP disclosed
EP-2857451-B1 PNEUMATIC TIRE YOKOHAMA RUBBER CO LTD (JP) 2019-05-08 EP disclosed
EP-2623315-B1 MULTILAYERED STRUCTURE, INNER LINER HAVING THE SAME, AND PNEUMATIC TIRE KURARAY CO (JP) 2019-04-17 EP disclosed
CN-101010362-A Multilayered pellet comprising ethylene/vinyl alcohol copolymer resin compositions KURARAY CO (JP) 2007-08-01 CN disclosed
EP-1785446-A1 MULTILAYERED PELLET COMPRISING ETHYLENE/VINYL ALCOHOL COPOLYMER RESIN COMPOSITIONS KURARAY CO., LTD. (JP) 2007-05-16 EP disclosed
CN-1294198-C Resin composition and multi-layer structures KURARAY CO (JP) 2007-01-10 CN disclosed
CN-1231501-C Modified ethylene-vinyl alcohol copolymer and method for producing same KURARAY CO (JP) 2005-12-14 CN disclosed
CN-1649956-A Resin composition and multi-layer structures KURARAY CO (JP) 2005-08-03 CN disclosed
US-20050147778-A1 Resin composition and multi-layer structures KURARAY CO., LTD. (JP) 2005-07-07 US disclosed
EP-1479725-A1 RESIN COMPOSITION AND MULTI-LAYER STRUCTURES Kuraray Co., Ltd. (JP) 2004-11-24 EP disclosed
US-20040096683-A1 Modified ethylene-vinyl alcohol copolymer and method for the production thereof KURARAY CO., LTD. (JP) 2004-05-20 US disclosed
EP-1403289-A1 MODIFIED ETHYLENE−VINYL ALCOHOL COPOLYMER AND METHOD FOR THE PRODUCTION THEREOF Kuraray Co., Ltd. (JP) 2004-03-31 EP disclosed
CN-1464883-A Modified ethylene-vinyl alcohol copolymer and method for producing same KURARAY CO (JP) 2003-12-31 CN disclosed