SCHEMBL589584

SCHEMBL589584

CCCCCN1CCC2CC=CC=C2C1

nearest known ligand 0.42

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
HTR1A P08908 7/20 0.42
DRD1 P21728 7/20 0.42
DRD4 P21917 7/20 0.42
DRD5 P21918 7/20 0.42
DRD3 P35462 7/20 0.42
DRD2 P14416 6/20 0.41
GNAI3 P08754 5/20 0.41
GNAO1 P09471 5/20 0.41
GNAI1 P63096 5/20 0.41
KCNH2 Q12809 2/20 0.40
ABCB1 P08183 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
SCHEMBL4824901 0.82 PRMT3 (0.36)
SCHEMBL3168555 0.76 QDPR (0.32)
SCHEMBL3173976 0.75 ABCB1 (0.42) HTR1ADRD1DRD4DRD5DRD3
SCHEMBL11390969 0.75 HTR1A (0.37) HTR1ADRD1DRD4DRD5DRD3
SCHEMBL4630963 0.75 ADRA1D (0.32) DRD3DRD2
SCHEMBL27992066 0.72 TLR9 (0.30)
SCHEMBL9637964 0.70 HTR1A (0.34) HTR1ADRD1DRD4DRD5DRD3
SCHEMBL6578631 0.70 DRD1 (0.33) HTR1ADRD1DRD4DRD5DRD3
SCHEMBL8872933 0.69
SCHEMBL28109507 0.69

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114874105-B Preparation method of visible light and water promoted homoallylic amine compound 大连理工大学 2023-03-03 CN claimed
CN-114874105-A Preparation method of visible light and water promoted homoallylic amine compound 大连理工大学 2022-08-09 CN claimed
EP-0245960-B1 PROCESS FOR PREPARING N-ACYLTETRAHYDROISOQUINOLINE Takasago Perfumery Co., Ltd. (JP) 1992-07-29 EP claimed
CN-110891938-B Tetrahydro-benzo [ D ] azepine derivatives as GPR120 modulators 卡尔丹治疗有限公司 2023-10-31 CN disclosed
CN-115772169-A Indoline [2,1-a ] isoquinoline derivative, preparation method and application 郑州大学 2023-03-10 CN disclosed
CN-114874105-B Preparation method of visible light and water promoted homoallylic amine compound 大连理工大学 2023-03-03 CN disclosed
CN-110891938-A Tetrahydro-benzo [ D ] azepin slow derivatives as GPR120 modulators 卡尔丹治疗有限公司 2020-03-17 CN disclosed
CN-104324754-A Preparation method and application of bimetallic catalytic photo-functional POM/MOFs UNIV DALIAN TECH 2015-02-04 CN disclosed
EP-1751111-B1 SUBSTITUTED 1,2,3,4-TETRAHYDROISOQUINOLINE DERIVATIVES ACTELION PHARMACEUTICALS LTD (CH) 2014-12-31 EP disclosed
US-8188082-B2 5,6,7,8-tetrahydro-imidazo[1,5-α]pyrazine derivatives ACTELION PHARMACEUTICALS LTD. (CH) 2012-05-29 US disclosed
EP-2125823-B1 5,6,7,8-TETRAHYDRO-IMIDAZO[1,5-A]PYRAZINE DERIVATIVES ACTELION PHARMACEUTICALS LTD (CH) 2012-02-15 EP disclosed
EP-0514851-A1 N-acyl-tetrahydroisoquinolines as inhibitors of acyl-coenzyme a:cholesterol acyl transferase SCHERING CORPORATION (US) 1992-11-25 EP disclosed
EP-0245960-B1 PROCESS FOR PREPARING N-ACYLTETRAHYDROISOQUINOLINE Takasago Perfumery Co., Ltd. (JP) 1992-07-29 EP disclosed
US-5124337-A Treating atherosclerosis SCHERING CORPORATION (US) 1992-06-23 US disclosed
US-5124337-A Treating atherosclerosis SCHERING CORPORATION (US) 1992-06-23 US disclosed
US-4851537-A Process for preparing N-acyltetrahydroisoquinoline TAKASAGO PERFUMERY CO., LTD. (JP) 1989-07-25 US disclosed
US-4851537-A Process for preparing N-acyltetrahydroisoquinoline TAKASAGO PERFUMERY CO., LTD. (JP) 1989-07-25 US disclosed
US-4851537-A Process for preparing N-acyltetrahydroisoquinoline TAKASAGO PERFUMERY CO., LTD. (JP) 1989-07-25 US disclosed
EP-0245960-A2 Process for preparing N-acyltetrahydroisoquinoline Takasago Perfumery Co., Ltd. (JP) 1987-11-19 EP disclosed
EP-0245960-A2 Process for preparing N-acyltetrahydroisoquinoline Takasago Perfumery Co., Ltd. (JP) 1987-11-19 EP disclosed