SCHEMBL1038841

SCHEMBL1038841

O=c1ccc2ccc(OCCCCCl)cc2[nH]1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 17/20 0.54
DRD4 P21917 3/20 0.49
DRD3 P35462 3/20 0.49
ACHE P22303 1/20 0.48
MAOB P27338 1/20 0.48
ADRB2 P07550 1/20 0.47
ADRB1 P08588 1/20 0.47
HTR1A P08908 1/20 0.47
ADRA2A P08913 1/20 0.47
ADRA2B P18089 1/20 0.47
ADRA2C P18825 1/20 0.47
DRD1 P21728 1/20 0.47
DRD5 P21918 1/20 0.47
SLC6A2 P23975 1/20 0.47
ADRA1D P25100 1/20 0.47
HTR1D P28221 1/20 0.47
HTR1B P28222 1/20 0.47
HTR2A P28223 1/20 0.47
HTR2C P28335 1/20 0.47
HTR1E P28566 1/20 0.47

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
SCHEMBL29433201 1.00 DRD2 (0.54) DRD2DRD4DRD3ACHEMAOB
SCHEMBL1039407 0.95 DRD2 (0.52) DRD2DRD4DRD3ACHEMAOB
SCHEMBL30712216 0.94 DRD2 (0.57) DRD2DRD4DRD3ACHEMAOB
SCHEMBL19732216 0.94 DRD2 (0.57) DRD2DRD4DRD3ACHEMAOB
SCHEMBL6586939 0.92 DRD2 (0.49) DRD2DRD4DRD3ACHEMAOB
SCHEMBL8860585 0.89 PDE3B (0.52) DRD2DRD4DRD3
SCHEMBL18507832 0.88 DRD2 (0.52) DRD2DRD4DRD3ACHEMAOB
SCHEMBL15854760 0.86 DRD2 (0.52) DRD2DRD4DRD3ACHEMAOB
SCHEMBL14772949 0.86 DRD2 (0.52) DRD2DRD4DRD3ACHEMAOB
SCHEMBL18507944 0.86 DRD2 (0.52) DRD2DRD4DRD3ACHEMAOB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118067866-A Method for detecting brexpiprazole intermediate and isomer related substances thereof 北京万全德众医药生物技术有限公司 2024-05-24 CN claimed
CN-117645602-A Impurity removal method of bripiprazole intermediate and preparation method of bripiprazole 黑龙江珍宝岛药业股份有限公司 2024-03-05 CN claimed
CN-112858524-B Detection method and application of brexpiprazole related substance 丽珠集团新北江制药股份有限公司 2022-12-20 CN claimed
CN-112858524-A Detection method and application of brexpiprazole related substance 丽珠集团新北江制药股份有限公司 2021-05-28 CN claimed
CN-104844585-B Method for preparing brexpiprazole 重庆医药工业研究院有限责任公司 2021-05-11 CN claimed
CN-109970705-B Method for preparing brexpiprazole intermediate and brexpiprazole by using cheap metal copper 浙江工业大学 2021-02-09 CN claimed
US-20260130904-A1 PIPERAZINE-SUBSTITUTED BENZOTHIOPHENE DERIVATIVES AS ANTIPSYCHOTIC AGENTS OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2026-05-14 US disclosed
US-20250241909-A1 INJECTABLE FORMULATION OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2025-07-31 US disclosed
US-20250121065-A1 INJECTABLE PREPARATION OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2025-04-17 US disclosed
CN-118817888-A Method for detecting related substances of bripiprazole 浙江国邦药业有限公司 2024-10-22 CN disclosed
US-20240277702-A1 INJECTABLE FORMULATION OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2024-08-22 US disclosed
US-12016927-B2 Injectable preparation OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2024-06-25 US disclosed
CN-118067866-A Method for detecting brexpiprazole intermediate and isomer related substances thereof 北京万全德众医药生物技术有限公司 2024-05-24 CN disclosed
US-20110152286-A1 PIPERAZINE-SUBSTITUTED BENZOTHIOPHENES FOR TREATMENT OF MENTAL DISORDERS OTSUKA PHARMACEUTICAL CO., LTD. 2011-06-23 US disclosed
US-7888362-B2 Piperazine-substituted benzothiophenes for treatment of mental disorders OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2011-02-15 US disclosed
EP-1869025-B1 PIPERAZINE-SUBSTITUTED BENZOTHIOPHENES FOR TREATMENT OF MENTAL DISORDERS OTSUKA PHARMA CO LTD (JP) 2011-01-26 EP disclosed
US-20100179322-A1 Piperazine-substituted benzothiophenes for treatment of mental disorders OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2010-07-15 US disclosed
CN-101302214-A Aralkyl piperidine (piperazidine) derivate and use thereof in mental disease treatment JIANGSU GUOHUA INVEST CO LTD (CN) 2008-11-12 CN disclosed
EP-1869025-A1 PIPERAZINE-SUBSTITUTED BENZOTHIOPHENES FOR TREATMENT OF MENTAL DISORDERS OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2007-12-26 EP disclosed
WO-2006112464-A1 PIPERAZINE-SUBSTITUTED BENZOTHIOPHENES FOR TREATMENT OF MENTAL DISORDERS OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2006-10-26 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (7 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-12016927-B2 Injectable preparation TNF, IL1B, F12 DRD2 782/4885DRD4 927/4885DRD3 1299/4885
US-20100179322-A1 Piperazine-substituted benzothiophenes for treatment of mental disorders GRIN2C, TPH1, HTR2C DRD2 126/4885DRD4 91/4885DRD3 154/4885
US-20250241909-A1 INJECTABLE FORMULATION SLC47A1, SLC18A1, ABCB11 DRD2 2024/4885DRD4 1857/4885DRD3 2724/4885
US-20260130904-A1 PIPERAZINE-SUBSTITUTED BENZOTHIOPHENE DERIVATIVES AS ANTIPSYCHOTIC AGENTS EBP, SIGMAR1, EP300 DRD2 163/4885DRD4 191/4885DRD3 387/4885
US-20240277702-A1 INJECTABLE FORMULATION SLC47A1, SLC18A1, ABCB11 DRD2 2024/4885DRD4 1857/4885DRD3 2724/4885
US-20110152286-A1 PIPERAZINE-SUBSTITUTED BENZOTHIOPHENES FOR TREATMENT OF MENTAL DISORDERS GRIN2C, TPH1, HTR2C DRD2 126/4885DRD4 91/4885DRD3 154/4885
US-20250121065-A1 INJECTABLE PREPARATION TNF, IL1B, F12 DRD2 785/4885DRD4 932/4885DRD3 1304/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.