SCHEMBL8511

SCHEMBL8511

Clc1cccc(N2CCNCC2)c1Cl

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 8/20 1.00
DRD3 P35462 8/20 1.00
ADRB1 P08588 4/20 1.00
HTR1A P08908 3/20 0.65
CYP1A2 P05177 2/20 0.65
CYP2D6 P10635 2/20 0.65
HTR3A P46098 2/20 0.65
CYP3A4 P08684 1/20 0.65
CYP2C9 P11712 1/20 0.65
DRD4 P21917 2/20 0.63
HTR2A P28223 2/20 0.63
HTR2C P28335 1/20 0.63
HTR6 P50406 2/20 0.53
HTR3E A5X5Y0 1/20 0.53
HTR3B O95264 1/20 0.53
NCF1 P14598 1/20 0.53
TSHR P16473 1/20 0.53
NFKB1 P19838 1/20 0.53
HTR1D P28221 1/20 0.53
HTR1B P28222 1/20 0.53

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
SCHEMBL29367982 1.00 DRD2 (1.00) DRD2DRD3ADRB1HTR1ACYP1A2
SCHEMBL6352699 1.00 DRD2 (1.00) DRD2DRD3ADRB1HTR1ACYP1A2
Hydrochloric Acid SCHEMBL2217039 0.98 DRD2 (0.96) DRD2DRD3ADRB1HTR1ACYP1A2
Hydrochloric Acid SCHEMBL29470848 0.98 DRD2 (0.96) DRD2DRD3ADRB1HTR1ACYP1A2
Bromide SCHEMBL981906 0.98 DRD2 (0.96) DRD2DRD3ADRB1HTR1ACYP1A2
Hydrochloric Acid SCHEMBL246338 0.98 DRD2 (0.96) DRD2DRD3ADRB1HTR1ACYP1A2
Piperazine SCHEMBL28251276 0.98 DRD2 (0.96) DRD2DRD3ADRB1HTR1ACYP1A2
Piperazine SCHEMBL28169968 0.96 DRD2 (0.93) DRD2DRD3ADRB1HTR1ACYP1A2
SCHEMBL3609605 0.93 DRD2 (0.87) DRD2DRD3ADRB1HTR1ACYP1A2
Hydrochloric Acid SCHEMBL253371 0.92 DRD2 (0.84) DRD2DRD3ADRB1HTR1ACYP1A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-113527227-B Preparation method of kalirazine 四川弘远药业有限公司 2024-06-21 CN claimed
CN-116178307-B Synthesis method of 1- (2, 3-dichlorophenyl) piperazine hydrochloride 浙江大洋生物科技集团股份有限公司 2024-05-14 CN claimed
US-20240024310-A1 CARBOSTYRIL DERIVATIVES AND MOOD STABILIZERS FOR TREATING MOOD DISORDERS OTSUKA PHARMA CO LTD (JP) 2024-01-25 US claimed
EP-4209474-A1 METHOD FOR MODIFYING THE SURFACE PROPERTIES OF ARTIFICIAL STONE AND ARTIFICIAL STONE MODIFIED BY THE METHOD N-Tec GmbH (DE) 2023-07-12 EP claimed
CN-116178307-A Synthesis method of 1- (2, 3-dichlorophenyl) piperazine hydrochloride 浙江大洋生物科技集团股份有限公司 2023-05-30 CN claimed
CN-109476617-B Industrial process for preparing cariprazine 吉瑞工厂 2023-04-04 CN claimed
CN-114751873-A Preparation method of 1- (2, 3-dichlorophenyl) piperazine 扬州市普林斯医药科技有限公司 2022-07-15 CN claimed
CN-114539184-A Preparation method of cariprazine intermediate 泰州精英化成医药科技有限公司 2022-05-27 CN claimed
CN-114539185-A Preparation method of cariprazine and intermediate thereof 上海博志研新药物技术有限公司 2022-05-27 CN claimed
EP-3481811-B1 INDUSTRIAL PROCESS FOR THE PREPARATION OF CARIPRAZINE RICHTER GEDEON NYRT (HU) 2022-05-25 EP claimed
US-20070032651-A1 Process for the preparation of carbostyril derivatives, such as aripiprazole and its intermediates DELMAR CHEMICALS, INC. (CA) 2007-02-08 US claimed
US-20060258869-A1 Process for the preparation of aripiprazole ALEMBIC LIMITED (IN) 2006-11-16 US claimed
CN-1784385-A Process for the preparation of carbostyril derivatives, such as aripiprazole and its intermediates DELMAR CHEMICALS INC (CA) 2006-06-07 CN claimed
US-20060079689-A1 Processes for preparing and purifying carbostyril compounds such as aripiprazole and 7-(4-halobutoxy)-3,4-dihydro-2(1H)-quinolinones CHEMAGIS LTD. (IL) 2006-04-13 US claimed
WO-2006030446-A1 PROCESS FOR THE PREPARATION OF POLYMORPHS, SOLVATES OF ARIPIPRAZOLE USING ARIPIPRAZOLE ACID SALTS MATRIX LABORATORIES LTD (IN) 2006-03-23 WO claimed
EP-1625116-A1 PROCESS FOR THE PREPARATION OF CARBOSTYRIL DERIVATIVES,SUCH AS ARIPIPRAZOLE AND ITS INTERMEDIATES Delmar Chemicals Inc. (CA) 2006-02-15 EP claimed
CN-1235880-C Quinolinenone kind derivative and its accetable salt, its preparation method, application in preparation of alipyrazole and preparation of alipyrazole CHONGQING MEDICINE INDUSTRY IN (CN) 2006-01-11 CN claimed
CN-1562973-A New method for preparing Aripiprazole NO 2 ARMY MEDICAL COLLEGE P L (CN) 2005-01-12 CN claimed
WO-2004099152-A1 PROCESS FOR THE PREPARATION OF CARBOSTYRIL DERIVATIVES, SUCH AS ARIPIPRAZOLE AND ITS INTERMEDIATES DELMAR CHEMICALS INC. (CA) 2004-11-18 WO claimed
CN-1513838-A Pot cooking sythesis method of alipyracole 江苏吴中苏药医药开发有限责任公司 2004-07-21 CN claimed

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

For each of this compound's patents that has machine-readable text (4 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-20070032651-A1 Process for the preparation of carbostyril derivatives, such as aripiprazole and its intermediates CYP4F8, CYP2A6, CYP2B6 DRD2 575/4885DRD3 956/4885ADRB1 1721/4885
US-20060258869-A1 Process for the preparation of aripiprazole CYP2F1, CYP3A4, CYP2A7 DRD2 266/4885DRD3 452/4885ADRB1 199/4885
US-20060079689-A1 Processes for preparing and purifying carbostyril compounds such as aripiprazole and 7-(4-halobutoxy)-3,4-dihydro-2(1H)-quinolinones HRH2, CYP2J2, HTR7 DRD2 370/4885DRD3 1405/4885ADRB1 122/4885
US-20240024310-A1 CARBOSTYRIL DERIVATIVES AND MOOD STABILIZERS FOR TREATING MOOD DISORDERS DRD2, CHRNA6, GABRA6 DRD2 1/4885DRD3 52/4885ADRB1 1218/4885

“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.