SCHEMBL27967916

SCHEMBL27967916

c1ccc(C2CCCCOC2)cc1

nearest known ligand 0.46

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
SLC18A3 Q16572 6/20 0.42
SIGMAR1 Q99720 2/20 0.41
TSHR P16473 2/20 0.40
TRPA1 O75762 1/20 0.40
KMO O15229 1/20 0.40
GAA P10253 1/20 0.39
MAPT P10636 1/20 0.39
TACR1 P25103 1/20 0.39
CYP2D6 P10635 2/20 0.39
CYP1A2 P05177 1/20 0.39
CYP2C9 P11712 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39

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
SCHEMBL7477065 0.94 SLC18A3 (0.42) SLC18A3SIGMAR1TSHRTRPA1GAA
SCHEMBL14849768 0.94 SLC18A3 (0.42) SLC18A3SIGMAR1TSHRTRPA1GAA
SCHEMBL23050200 0.85 SLC18A3 (0.45) SLC18A3SIGMAR1TSHRGAAMAPT
SCHEMBL2479517 0.85 SLC18A3 (0.45) SLC18A3SIGMAR1TSHRGAAMAPT
SCHEMBL19539969 0.84 SLC18A3 (0.46) SLC18A3SIGMAR1TSHRTRPA1KMO
SCHEMBL23483033 0.83 PRKAB2 (0.45)
SCHEMBL27998912 0.81 TACR1 (0.37) TSHRTACR1SMN1; SMN2
SCHEMBL14849673 0.79 KDM1A (0.44) TSHRSMN1; SMN2
Benzene SCHEMBL28162034 0.78 SLC18A3 (0.61) SLC18A3SIGMAR1TSHRTRPA1KMO
Fluoride SCHEMBL27670473 0.78 SLC18A3 (0.61) SLC18A3SIGMAR1TSHRTRPA1KMO

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-104448451-A Thermoplastic elastomer composition YOKOHAMA RUBBER CO LTD 2015-03-25 CN claimed
CN-107116869-B Multilayer structure making, pneumatic tire inner liner and pneumatic tire 株式会社普利司通 2019-04-30 CN disclosed
CN-109535707-A Pneumatic tire 横滨橡胶株式会社 2019-03-29 CN disclosed
CN-105408413-B The manufacturing method of thermoplastic resin composition 横滨橡胶株式会社 2018-07-03 CN disclosed
CN-107116869-A Multilayer structure making, pneumatic tire inner liner and pneumatic tire 株式会社普利司通 2017-09-01 CN disclosed
CN-104125982-B Thermoplastic resin composition and the tire using which 横滨橡胶株式会社 2017-03-15 CN disclosed
CN-103732398-B Multilayer structure, inner liner for pneumatic tire, and pneumatic tire 株式会社普利司通 2016-07-06 CN disclosed
CN-103648798-B Inner liner for pneumatic tire, its manufacture method and air-inflation tyre KURARAY CO.,LTD. (JP) 2016-04-20 CN disclosed
CN-105408413-A Process for producing thermoplastic resin composition YOKOHAMA RUBBER CO LTD 2016-03-16 CN disclosed
CN-103118871-B Multilayer structure making, the liner using this multilayer structure making and pneumatic tire KURARAY CO.,LTD. (JP) 2016-01-20 CN disclosed
CN-103732396-B Multilayer structure making, pneumatic tire inner liner and pneumatic tire BRIDGESTONE CO.,LTD. (JP) 2016-01-20 CN disclosed
CN-102858878-B Thermoplastic resin composition and tire using same YOKOHAMA RUBBER CO LTD 2015-06-10 CN disclosed
CN-102686649-B Method for producing thermoplastic resin compositions YOKOHAMA RUBBER CO LTD 2015-05-13 CN disclosed
CN-104448451-A Thermoplastic elastomer composition YOKOHAMA RUBBER CO LTD 2015-03-25 CN disclosed
CN-101993577-B Thermoplastic elastomer composition YOKOHAMA RUBBER CO LTD 2015-03-11 CN disclosed
CN-104334634-A Pneumatic tire YOKOHAMA RUBBER CO LTD 2015-02-04 CN disclosed
CN-102361939-B Thermoplastic resin composition YOKOHAMA RUBBER CO LTD 2015-01-14 CN disclosed