SCHEMBL234280

SCHEMBL234280

COc1ccc(N2CCNCC2)cc1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ADRB1 P08588 5/20 1.00
HTR3E A5X5Y0 3/20 1.00
HTR3B O95264 3/20 1.00
HTR3A P46098 3/20 1.00
HTR3D Q70Z44 3/20 1.00
HTR3C Q8WXA8 3/20 1.00
SIGMAR1 Q99720 2/20 1.00
HTR1A P08908 3/20 0.68
HTR1B P28222 2/20 0.68
HTR1D P28221 1/20 0.68
LTA4H P09960 4/20 0.62
HTR2C P28335 1/20 0.59
TGFBR1 P36897 2/20 0.58
HTR7 P34969 2/20 0.57
HTR2B P41595 1/20 0.56
HTR6 P50406 1/20 0.56

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
SCHEMBL2410870 1.00 ADRB1 (1.00) ADRB1HTR3EHTR3BHTR3AHTR3D
Bromide SCHEMBL11070661 0.98 ADRB1 (0.96) ADRB1HTR3EHTR3BHTR3AHTR3D
Hydrochloric Acid SCHEMBL2302729 0.98 ADRB1 (0.96) ADRB1HTR3EHTR3BHTR3AHTR3D
Hydrochloric Acid SCHEMBL1724680 0.98 ADRB1 (0.96) ADRB1HTR3EHTR3BHTR3AHTR3D
Piperazine SCHEMBL8590918 0.98 ADRB1 (0.96) ADRB1HTR3EHTR3BHTR3AHTR3D
SCHEMBL2881283 0.94 ADRB1 (0.89) ADRB1HTR3EHTR3BHTR3AHTR3D
SCHEMBL9058690 0.94 ADRB1 (0.89) ADRB1HTR3EHTR3BHTR3AHTR3D
SCHEMBL5237992 0.93 ADRB1 (0.86) ADRB1HTR3EHTR3BHTR3AHTR3D
SCHEMBL7171062 0.93 ADRB1 (0.86) ADRB1HTR3EHTR3BHTR3AHTR3D
Hydrochloric Acid SCHEMBL7921830 0.93 ADRB1 (0.86) ADRB1HTR3EHTR3BHTR3AHTR3D

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 1802 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117069676-B 6-Methoxybenzothiazole compound and preparation method and application thereof 北京中医药大学 2024-06-18 CN claimed
CN-117069676-A 6-methoxybenzothiazole compound and preparation method and application thereof 北京中医药大学 2023-11-17 CN claimed
CN-111362886-B Preparation method of posaconazole intermediate 1- (4-aminophenyl) -4- (4-hydroxyphenyl) piperazine 四川澄华生物科技有限公司 2023-05-16 CN claimed
CN-111848412-B Method for efficiently realizing N-alkylation reaction by using cycloiridium catalyst 赣南医学院 2023-05-12 CN claimed
CN-112979546-B Butyrylcholine esterase selective inhibitor and preparation method and application thereof 中国药科大学 2023-01-31 CN claimed
CN-112831206-B Inorganic oxide dispersion with controllable water content and preparation method thereof 凯斯科技股份有限公司 2022-12-30 CN claimed
WO-2022233109-A1 RUBBER CONTAINING MODIFIED GRAPHENE 福建师范大学泉港石化研究院 2022-11-10 WO claimed
CN-111795963-B Method for chromogenic detection of piperazine novel psychotropic active substances 福建警察学院 2022-05-03 CN claimed
CN-111879767-B Color development test method of piperazine novel mental active substance 福建警察学院 2022-05-03 CN claimed
CN-113185759-B Rubber containing modified graphene 福建师范大学泉港石化研究院 2022-04-01 CN claimed
EP-0567982-B1 Azole compounds, their production and use TAKEDA CHEMICAL INDUSTRIES LTD (JP) 1998-07-01 EP claimed
EP-0804443-A4 NON-NUCLEOTIDE PHOSPHORUS ESTER OLIGOMERS PHARMAGENICS INC (US) 1998-04-29 EP claimed
EP-0804443-A1 NON-NUCLEOTIDE PHOSPHORUS ESTER OLIGOMERS PHARMAGENICS, INC. (US) 1997-11-05 EP claimed
WO-1997028168-A1 NON-NUCLEOTIDE PHOSPHOROUS ESTER OLIGOMERS PHARMAGENICS, INC. (US) 1997-08-07 WO claimed
WO-1996022297-A9 NON-NUCLEOTIDE PHOSPHORUS ESTER OLIGOMERS 1996-10-03 WO claimed
WO-1996022297-A1 NON-NUCLEOTIDE PHOSPHORUS ESTER OLIGOMERS PHARMAGENICS, INC. (US) 1996-07-25 WO claimed
EP-0539180-A1 Antiviral agents SANWA KAGAKU KENKYUSHO CO., LTD. (JP) 1993-04-28 EP claimed
US-4247551-A N-Pyrrolyl-pyridazineamines and their use as antihypertensive agents GRUPPO LEPETIT S.P.A. (IT) 1981-01-27 US claimed
EP-0009655-A1 6-Amino substituted N-pyrrolyl-3-pyridazine amines, their preparation, and pharmaceutically antihypertensive compositions containing them GRUPPO LEPETIT S.P.A. (IT) 1980-04-16 EP claimed
US-4036979-A ANIMAL GROWTH RATE ACCELERATOR AMERICAN CYANAMID COMPANY (US) 1977-07-19 US claimed