SCHEMBL15901709

SCHEMBL15901709

CC(N)(CCCl)CCc1ccccc1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TAAR1 Q96RJ0 4/20 0.45
SLC6A2 P23975 2/20 0.45
SMN1; SMN2 Q16637 2/20 0.40
CYP2A6 P11509 1/20 0.40
HTR2A P28223 1/20 0.40
LOXL2 Q9Y4K0 1/20 0.40
AOC3 Q16853 4/20 0.38
MAOA P21397 4/20 0.38
MAOB P27338 3/20 0.38
GRM2 Q14416 1/20 0.37
GRM3 Q14832 1/20 0.37
ALDH1A1 P00352 2/20 0.37
S1PR4 O95977 1/20 0.37
S1PR1 P21453 1/20 0.37
S1PR3 Q99500 1/20 0.37
HPGD P15428 1/20 0.37
ALOX15 P16050 1/20 0.37
ALOX12 P18054 1/20 0.37
CASP1 P29466 1/20 0.37
HSD17B10 Q99714 1/20 0.37

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
SCHEMBL21058237 0.90 TAAR1 (0.54) TAAR1SLC6A2SMN1; SMN2CYP2A6HTR2A
SCHEMBL15637911 0.82 SLC6A2 (0.57) TAAR1SLC6A2SMN1; SMN2HTR2ALOXL2
SCHEMBL3842271 0.80 SMN1; SMN2 (0.43) TAAR1SLC6A2SMN1; SMN2CYP2A6HTR2A
SCHEMBL5981842 0.80 TAAR1 (0.48) TAAR1SLC6A2SMN1; SMN2CYP2A6HTR2A
SCHEMBL9466924 0.80 TAAR1 (0.48) TAAR1SLC6A2SMN1; SMN2CYP2A6HTR2A
SCHEMBL21058255 0.79 S1PR1 (0.48) TAAR1SLC6A2S1PR4S1PR1S1PR3
SCHEMBL5428396 0.78 TAAR1 (0.47) TAAR1SLC6A2SMN1; SMN2CYP2A6HTR2A
SCHEMBL9183600 0.78 TAAR1 (0.47) TAAR1SLC6A2SMN1; SMN2CYP2A6HTR2A
Bromide SCHEMBL499589 0.78 SMN1; SMN2 (0.41) TAAR1SLC6A2SMN1; SMN2CYP2A6HTR2A
SCHEMBL15901633 0.78 TNNC1 (0.39) TAAR1SLC6A2SMN1; SMN2CYP2A6HTR2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11248064-B2 Conjugated diene polymer, conjugated diene polymer composition, and tire JAPAN ELASTOMER CO., LTD. (JP) 2022-02-15 US disclosed
CN-110167977-B Conjugated diene polymer, conjugated diene polymer composition, and tire 日本弹性体株式会社 2021-11-16 CN disclosed
CN-109476778-B Modified conjugated diene polymer, modified conjugated diene polymer composition, tire, and method for producing modified conjugated diene polymer 日本弹性体株式会社 2021-05-11 CN disclosed
EP-3581597-B1 CONJUGATED DIENE POLYMER, CONJUGATED DIENE POLYMER COMPOSITION, AND TIRE JAPAN ELASTOMER CO LTD (JP) 2021-05-05 EP disclosed
CN-107250172-B Modified conjugated diene polymer, method for producing same, and modified conjugated diene polymer composition 旭化成株式会社 2021-04-09 CN disclosed
CN-109384982-B Modified conjugated diene polymer composition and tire 旭化成株式会社 2020-11-17 CN disclosed
EP-3517552-B1 MODIFIED CONJUGATED DIENE POLYMER, MODIFIED CONJUGATED DIENE POLYMER COMPOSITION, TIRE, AND METHOD FOR PRODUCING MODIFIED CONJUGATED DIENE POLYMER JAPAN ELASTOMER CO LTD (JP) 2020-11-11 EP disclosed
US-10822446-B2 Modified conjugated diene polymer, modified conjugated diene polymer composition, tire, and method for producing modified conjugated diene polymer JAPAN ELASTOMER CO., LTD. (JP) 2020-11-03 US disclosed
US-10766972-B2 Modified conjugated diene-based polymer and method for producing the same, and modified conjugated diene-based polymer composition ASAHI KASEI KABUSHIKI KAISHA (JP) 2020-09-08 US disclosed
EP-3517552-A1 MODIFIED CONJUGATED DIENE POLYMER, MODIFIED CONJUGATED DIENE POLYMER COMPOSITION, TIRE, AND METHOD FOR PRODUCING MODIFIED CONJUGATED DIENE POLYMER Japan Elastomer Co., Ltd. (JP) 2019-07-31 EP disclosed
EP-3260476-B1 MODIFIED CONJUGATED DIENE-BASED POLYMER, MANUFACTURING METHOD THEREOF, AND MODIFIED CONJUGATED DIENE-BASED POLYMER COMPOSITION ASAHI CHEMICAL IND (JP) 2019-05-08 EP disclosed
US-20180037674-A1 Modified Conjugated Diene-Based Polymer and Method for Producing the Same, and Modified Conjugated Diene-Based Polymer Composition ASAHI KASEI KABUSHIKI KAISHA (JP) 2018-02-08 US disclosed
EP-3260476-A1 MODIFIED CONJUGATED DIENE-BASED POLYMER, MANUFACTURING METHOD THEREOF, AND MODIFIED CONJUGATED DIENE-BASED POLYMER COMPOSITION Asahi Kasei Kabushiki Kaisha (JP) 2017-12-27 EP disclosed
US-9085653-B2 Method for producing modified conjugated diene-based polymer, modified conjugated diene-based polymer, modified conjugated diene-based polymer composition, rubber composition and tire ASAHI KASEI CHEMICALS CORPORATION (JP) 2015-07-21 US disclosed
EP-2754674-B1 METHOD FOR PRODUCING MODIFIED CONJUGATED DIENE POLYMER, MODIFIED CONJUGATED DIENE POLYMER, MODIFIED CONJUGATED DIENE POLYMER COMPOSITION, RUBBER COMPOSITION, AND TIRE ASAHI KASEI CHEMICALS CORP (JP) 2015-03-11 EP disclosed
US-20140213721-A1 Method for Producing Modified Conjugated Diene-Based Polymer, Modified Conjugated Diene-Based Polymer, Modified Conjugated Diene-Based Polymer Composition, Rubber Composition and Tire ASAHI KASEI CHEMICALS CORPORATION (JP) 2014-07-31 US disclosed