SCHEMBL15901630

SCHEMBL15901630

CCC(Cl)(CCN)CCc1ccccc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTR2A P28223 2/20 0.47
SMN1; SMN2 Q16637 2/20 0.47
TAAR1 Q96RJ0 2/20 0.47
LOXL2 Q9Y4K0 2/20 0.47
CYP2A6 P11509 1/20 0.47
MAOA P21397 2/20 0.42
CYP1A2 P05177 2/20 0.40
CYP2D6 P10635 2/20 0.40
CYP2C19 P33261 2/20 0.40
AOC3 Q16853 3/20 0.38
ATM Q13315 1/20 0.38
NPC1 O15118 1/20 0.38
KDM1A O60341 1/20 0.38
ALDH1A1 P00352 1/20 0.38
LMNA P02545 1/20 0.38
CYP3A4 P08684 1/20 0.38
HTR1A P08908 1/20 0.38
ADRA2A P08913 1/20 0.38
CYP2C8 P10632 1/20 0.38
CYP2C9 P11712 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
SCHEMBL15901702 0.84 TAAR1 (0.44) HTR2ASMN1; SMN2TAAR1LOXL2CYP2A6
Ammonia Solution, Strong SCHEMBL5181798 0.78 KCNH2 (0.44) HTR2ASIGMAR1
Ammonia Solution, Strong SCHEMBL5183461 0.78 KCNH2 (0.44) HTR2ASIGMAR1
SCHEMBL5529055 0.78 ALDH1A1 (0.48) HTR2ASMN1; SMN2TAAR1LOXL2CYP2A6
SCHEMBL15901706 0.78 TAAR1 (0.50) HTR2ASMN1; SMN2TAAR1LOXL2CYP2A6
SCHEMBL28042752 0.73 TP53 (0.41) HTR2ASMN1; SMN2TAAR1LOXL2CYP2A6
SCHEMBL10766520 0.71 TAAR1 (0.45) HTR2ASMN1; SMN2TAAR1LOXL2CYP2A6
SCHEMBL21058275 0.71 TAAR1 (0.45) HTR2ASMN1; SMN2TAAR1LOXL2CYP2A6
Phosphine SCHEMBL9623189 0.71 MAOB (0.41) HTR2ASMN1; SMN2TAAR1LOXL2CYP2A6
SCHEMBL11833281 0.71

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