Aripiprazole

Aripiprazole

SCHEMBL8044

Cl.O=C1CCc2ccc(OCCCCN3CCN(c4cccc(Cl)c4Cl)CC3)cc2N1

nearest known ligand 0.98

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

DRD2HTR1AHTR2A

The experimentally established mechanism targets of Aripiprazole. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DRD2 known ✓ P14416 20/20 0.98
HTR1A known ✓ P08908 3/20 0.98
HTR2A known ✓ P28223 3/20 0.98
DRD3 P35462 5/20 0.98
DRD4 P21917 4/20 0.98
HTR2B P41595 3/20 0.98
DRD1 P21728 2/20 0.98
DRD5 P21918 2/20 0.98
HTR2C P28335 2/20 0.98
HTR7 P34969 2/20 0.98
HTR6 P50406 2/20 0.98
HTR3E A5X5Y0 1/20 0.98
MEN1 O00255 1/20 0.98
MLNR O43193 1/20 0.98
HTR3B O95264 1/20 0.98
ABCB11 O95342 1/20 0.98
ESR1 P03372 1/20 0.98
PGR P06401 1/20 0.98
ADRB2 P07550 1/20 0.98
CHRM2 P08172 1/20 0.98

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
Aripiprazole SCHEMBL29935430 1.00 DRD2 (0.98) DRD2DRD3DRD4HTR1AHTR2A
Aripiprazole SCHEMBL29475638 0.99 DRD2 (1.00) DRD2DRD3DRD4HTR1AHTR2A
Aripiprazole SCHEMBL29438823 0.99 DRD2 (1.00) DRD2DRD3DRD4HTR1AHTR2A
Aripiprazole SCHEMBL982189 0.99 DRD2 (1.00) DRD2DRD3DRD4HTR1AHTR2A
Aripiprazole SCHEMBL29356997 0.99 DRD2 (1.00) DRD2DRD3DRD4HTR1AHTR2A
Aripiprazole SCHEMBL8255 0.99 DRD2 (1.00) DRD2DRD3DRD4HTR1AHTR2A
Aripiprazole SCHEMBL29475637 0.99 DRD2 (1.00) DRD2DRD3DRD4HTR1AHTR2A
Aripiprazole SCHEMBL7097505 0.98 DRD2 (0.98) DRD2DRD3DRD4HTR1AHTR2A
Aripiprazole SCHEMBL236666 0.98 DRD2 (0.98) DRD2DRD3DRD4HTR1AHTR2A
Aripiprazole SCHEMBL5147095 0.98 DRD2 (0.98) DRD2DRD3DRD4HTR1AHTR2A

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-108069900-B Preparation method and application of aripiprazole hydrochloride 齐鲁制药有限公司 2022-09-23 CN claimed
CN-108069900-A The preparation method and purposes of Aripiprazole hydrochloride 齐鲁制药有限公司 2018-05-25 CN claimed
US-20100204470-A1 METHOD FOR SALT PREPARATION SANDOZ AG 2010-08-12 US claimed
US-20100113784-A1 PROCESS FOR PREPARING CRYSTALLINE ARIPIPRAZOLE CADILA HEALTH CARE LIMITED (IN) 2010-05-06 US claimed
EP-2084133-A2 PROCESS FOR PREPARING CRYSTALLINE ARIPIPRAZOLE Cadila Healthcare Limited (IN) 2009-08-05 EP claimed
EP-2032521-A2 NEW METHOD FOR SALT PREPARATION Sandoz AG (CH) 2009-03-11 EP claimed
US-20080182856-A1 Characterized by x-ray powder diffraction pattern having peaks expressed as 2 theta at 6.2, 8.5, 11.5, 15.2, 15.5, 16.8, 17.2, 18.3, 18.9, 19.6, 20.6, 21.3, 23.4, 24.1, 24.7, 25.9, 27.5, 28.3, 28.9, 32.8 degrees; preparation via crystal form of hydrochloride serves in producing pure aripiprazole HETERO DRUGS LIMITED (IN) 2008-07-31 US claimed
WO-2008059518-A2 PROCESS FOR PREPARING CRYSTALLINE ARIPIPRAZOLE CADILA HEALTHCARE LIMITED (IN) 2008-05-22 WO claimed
US-20080085903-A1 NOVEL CRYSTALLINE FORMS OF ARIPIPRAZOLE HETERO DRUGS LIMITED (IN) 2008-04-10 US claimed
US-20080086005-A1 NOVEL CRYSTALLINE FORMS OF ARIPIPRAZOLE HETERO DRUGS LIMITED (IN) 2008-04-10 US claimed
WO-2008000418-A2 NEW METHOD FOR SALT PREPARATION SANDOZ AG (CH) 2008-01-03 WO claimed
EP-1606262-A1 NOVEL CRYSTALLINE FORMS OF ARIPIPRAZOLE Hetero Drugs Limited (IN) 2005-12-21 EP claimed
US-20050159429-A1 Novel crystalline forms of aripiprazole HETERO DRUGS LIMITED (IN) 2005-07-21 US claimed
WO-2004083183-A1 NOVEL CRYSTALLINE FORMS OF ARIPIPRAZOLE HETERO DRUGS LIMITED (IN) 2004-09-30 WO claimed
CN-116338030-A Method for detecting antipsychotics and antidepressants in human milk by HPLC-MS/MS method 厦门市仙岳医院(厦门市精神卫生中心、厦门医学院附属仙岳医院) 2023-06-27 CN disclosed
CN-108069900-B Preparation method and application of aripiprazole hydrochloride 齐鲁制药有限公司 2022-09-23 CN disclosed
CN-108069900-B Preparation method and application of aripiprazole hydrochloride 齐鲁制药有限公司 2022-09-23 CN disclosed
EP-0367141-B1 Carbostyril derivatives OTSUKA PHARMA CO LTD (JP) 1996-01-10 EP disclosed
US-5006528-A Carbostyril derivatives OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1991-04-09 US disclosed
EP-0367141-A2 Carbostyril derivatives OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1990-05-09 EP 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 (5 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-20080182856-A1 Characterized by x-ray powder diffraction pattern having peaks expressed as 2 theta at 6.2, 8.5, 11.5, 15.2, 15.5, 16.8, 17.2, 18.3, 18.9, 19.6, 20.6, 21.3, 23.4, 24.1, 24.7, 25.9, 27.5, 28.3, 28.9, 32.8 degrees; preparation via crystal form of hydrochloride serves in producing pure aripiprazole ADRA2C, YWHAQ, CYP2C18 DRD2 273/4885HTR1A 84/4885HTR2A 56/4885
US-20080085903-A1 NOVEL CRYSTALLINE FORMS OF ARIPIPRAZOLE ATG4A, ATG4B, CYP4F3 DRD2 1403/4885HTR1A 130/4885HTR2A 82/4885
US-20080086005-A1 NOVEL CRYSTALLINE FORMS OF ARIPIPRAZOLE ATG4A, ATG4B, CYP4F3 DRD2 1403/4885HTR1A 130/4885HTR2A 82/4885
US-20050159429-A1 Novel crystalline forms of aripiprazole ATG4A, ATG4B, CYP4F3 DRD2 1403/4885HTR1A 130/4885HTR2A 82/4885
US-20100113784-A1 PROCESS FOR PREPARING CRYSTALLINE ARIPIPRAZOLE CYP2F1, CYP3A5, CYP2A6 DRD2 1618/4885HTR1A 390/4885HTR2A 432/4885

“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.