SCHEMBL1255253

SCHEMBL1255253

COc1ccccc1N1CCN(CCCCl)CC1

nearest known ligand 0.78

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 2/20 0.78
DRD3 P35462 1/20 0.78
HTR1A P08908 2/20 0.76
HTR7 P34969 3/20 0.70
HTR2A P28223 2/20 0.70
ADRA1D P25100 1/20 0.68
ADRA1A P35348 1/20 0.68
ADRA1B P35368 1/20 0.68
MEN1 O00255 1/20 0.67
CYP1A2 P05177 1/20 0.67
CYP2C9 P11712 1/20 0.67
CYP2C19 P33261 1/20 0.67
KMT2A Q03164 1/20 0.67
ALDH1A1 P00352 2/20 0.67
SLC6A2 P23975 1/20 0.67
SLC6A4 P31645 1/20 0.67
KDM4E B2RXH2 1/20 0.67
TDP1 Q9NUW8 1/20 0.67
LMNA P02545 1/20 0.67
SMN1; SMN2 Q16637 1/20 0.67

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
SCHEMBL30206503 1.00 DRD2 (0.78) DRD2DRD3HTR1AHTR7HTR2A
Hydrochloric Acid SCHEMBL11651993 0.98 DRD2 (0.76) DRD2DRD3HTR1AHTR7HTR2A
Hydrochloric Acid SCHEMBL8980706 0.98 DRD2 (0.76) DRD2DRD3HTR1AHTR7HTR2A
SCHEMBL8121554 0.97 HTR1A (0.77) DRD2DRD3HTR1AHTR7HTR2A
SCHEMBL1253155 0.92 DRD2 (0.75) DRD2DRD3HTR1AHTR7ADRA1D
SCHEMBL6526368 0.92 DRD2 (0.85) DRD2DRD3HTR1AHTR7HTR2A
SCHEMBL10676614 0.88 DRD2 (0.68) DRD2DRD3HTR1AHTR7HTR2A
SCHEMBL10414460 0.88 DRD2 (1.00) DRD2DRD3HTR1AHTR7HTR2A
SCHEMBL7433412 0.87 DRD2 (0.76) DRD2DRD3HTR1AHTR7HTR2A
SCHEMBL2215388 0.87 DRD2 (0.76) DRD2DRD3HTR1AHTR7HTR2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-110511215-B Aryl piperazine/piperidine compound and application thereof 复旦大学 2023-03-28 CN disclosed
US-20150051219-A1 TREATMENT OF ORGANOPHOSPHATE EXPOSURE WITH TETRAHYDROINDOLONE ARYLPIPERAZINE COMPOUNDS HELTON DAVID REED (US) 2015-02-19 US disclosed
US-20110172242-A1 TREATMENT OF ORGANOPHOSPHATE EXPOSURE WITH TETRAHYDROINDOLONE ARYLPIPERAZINE COMPOUNDS ABRAXIS BIOSCIENCE, INC. 2011-07-14 US disclosed
EP-2285373-A2 TREATMENT OF ORGANOPHOSPHATE EXPOSURE WITH TETRAHYDROINDOLONE ARYLPIPERAZINE COMPOUNDS Cenomed Biosciences, LLC (US) 2011-02-23 EP disclosed
EP-2219648-A1 TREATMENT OF POST-TRAUMATIC STRESS DISORDER WITH TETRAHYDROINDOLONE ARYLPIPERAZINE COMPOUNDS Cenomed Biosciences, LLC (US) 2010-08-25 EP disclosed
WO-2010036395-A2 TREATMENT OF ORGANOPHOSPHATE EXPOSURE WITH TETRAHYDROINDOLONE ARYLPIPERAZINE COMPOUNDS CENOMED BIOSCIENCES, LLC (US) 2010-04-01 WO disclosed
US-20090264443-A1 TREATMENT OF ORGANOPHOSPHATE EXPOSURE WITH TETRAHYDROINDOLONE ARYLPIPERAZINE COMPOUNDS ABRAXIS BIOSCIENCE, INC. 2009-10-22 US disclosed
US-20090156609-A1 TREATMENT OF POST-TRAUMATIC STRESS DISORDER WITH TETRAHYDROINDOLONE ARYLPIPERZAINE COMPOUNDS ABRAXIS BIOSCIENCE, INC. 2009-06-18 US disclosed
WO-2009062134-A1 TREATMENT OF POST-TRAUMATIC STRESS DISORDER WITH TETRAHYDROINDOLONE ARYLPIPERAZINE COMPOUNDS CENOMED BIOSCIENCES, LLC (US) 2009-05-14 WO disclosed
EP-1764134-B1 Purine derivatives linked to arylpiperazines SPECTRUM PHARMACEUTICALS INC (US) 2009-01-28 EP disclosed
US-4619929-A SEDATIVES, HYPOTENSIVE AGENTS BASF AKTIENGESELLSCHAFT (DE) 1986-10-28 US disclosed
US-4552878-A ANTIDEPRESSANTS LIPHA, LYONNAISE INDUSTRIELLE PHARMACEUTIQUE (FR) 1985-11-12 US disclosed
EP-0056866-B1 PHENYLPIPERAZINE DERIVATIVES OF HETERYLPHENOLS AND HETARYLANILINES, THEIR PREPARATION AND THEIR PHARMACEUTICAL COMPOSITIONS BASF Aktiengesellschaft (DE) 1985-06-19 EP disclosed
EP-0056866-A2 Phenylpiperazine derivatives of heterylphenols and hetarylanilines, their preparation and their pharmaceutical compositions BASF Aktiengesellschaft (DE) 1982-08-04 EP disclosed
US-4328227-A HYPOTENSIVE AGENTS HOECHST AKTIENGESELLSCHAFT (DE) 1982-05-04 US disclosed
US-3997667-A HYPOTENSIVE BOEHRINGER MANNHEIM G.M.B.H. (DT) 1976-12-14 US disclosed
US-3996361-A ANTIEDEMATOUS, REDUCING CAPILLARY PERMEABILITY BOEHRINGER MANNHEIM G.M.B.H. (DT) 1976-12-07 US disclosed
US-3960873-A 1-Phenylthiopropyl-4-hydroxy-4-phenyl piperidines SUMITOMO CHEMICAL CO., LTD. (JA) 1976-06-01 US disclosed
US-3947446-A HYPOTENSIVE BOEHRINGER MANNHEIM GMBH (DT) 1976-03-30 US disclosed
US-3932411-A HYPOTENSIVE, TRANQUILIZERS, SEDATIVES, ANTIEDEMIC BOEHRINGER MANNHEIM G.M.B.H. (DT) 1976-01-13 US 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 (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-20090156609-A1 TREATMENT OF POST-TRAUMATIC STRESS DISORDER WITH TETRAHYDROINDOLONE ARYLPIPERZAINE COMPOUNDS HTR5A, HTR2C, HTR3B DRD2 21/4885DRD3 34/4885HTR1A 8/4885
US-20110172242-A1 TREATMENT OF ORGANOPHOSPHATE EXPOSURE WITH TETRAHYDROINDOLONE ARYLPIPERAZINE COMPOUNDS DDT, CYP4X1, AHR DRD2 1585/4885DRD3 1448/4885HTR1A 440/4885
US-20150051219-A1 TREATMENT OF ORGANOPHOSPHATE EXPOSURE WITH TETRAHYDROINDOLONE ARYLPIPERAZINE COMPOUNDS DDT, CYP4X1, AHR DRD2 1585/4885DRD3 1448/4885HTR1A 440/4885
US-20090264443-A1 TREATMENT OF ORGANOPHOSPHATE EXPOSURE WITH TETRAHYDROINDOLONE ARYLPIPERAZINE COMPOUNDS DDT, CYP4X1, AHR DRD2 1585/4885DRD3 1448/4885HTR1A 440/4885

“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.