SCHEMBL791048

SCHEMBL791048

O=C1c2ccccc2C(=O)N1CCCCN1CCC(c2noc3cc(F)ccc23)CC1

nearest known ligand 0.70

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 9/20 0.70
HTR2A P28223 6/20 0.70
MCHR1 Q99705 1/20 0.68
ACHE P22303 2/20 0.66
SLC6A4 P31645 1/20 0.64
HTR1A P08908 1/20 0.63
HTR2C P28335 1/20 0.61
KCNH2 Q12809 1/20 0.61
HTR7 P34969 2/20 0.60
HTR6 P50406 2/20 0.60

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
Hydrochloric Acid SCHEMBL9596033 0.99 DRD2 (0.69) DRD2HTR2AMCHR1ACHESLC6A4
SCHEMBL793140 0.98 DRD2 (0.70) DRD2HTR2AMCHR1ACHESLC6A4
SCHEMBL1544931 0.94 ACHE (0.71) DRD2HTR2AMCHR1ACHESLC6A4
Hydrochloric Acid SCHEMBL1545126 0.93 ACHE (0.70) DRD2HTR2AMCHR1ACHESLC6A4
SCHEMBL1545401 0.88 ACHE (0.71) DRD2HTR2AMCHR1ACHESLC6A4
SCHEMBL1545289 0.88 ACHE (0.65) DRD2HTR2AMCHR1ACHESLC6A4
SCHEMBL1545965 0.87 ACHE (0.67) DRD2HTR2AMCHR1ACHESLC6A4
Fumaric Acid SCHEMBL1545814 0.87 ACHE (0.62) DRD2HTR2AMCHR1ACHESLC6A4
Fumaric Acid SCHEMBL1545815 0.87 ACHE (0.62) DRD2HTR2AMCHR1ACHESLC6A4
Hydrochloric Acid SCHEMBL1545683 0.87 ACHE (0.64) DRD2HTR2AMCHR1ACHESLC6A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-1993016073-A1 PIPERAZINE AND PIPERIDINE DERIVATIVES, AND THEIR USE AS ANTIPSYCHOTICS THE WELLCOME FOUNDATION LIMITED (GB) 1993-08-19 WO claimed
US-9120767-B2 Arylosulfonamides for the treatment of CNS diseases ADAMED SP. Z.O.O. (PL) 2015-09-01 US disclosed
US-20140336200-A1 ARYLOSULFONAMIDES FOR THE TREATMENT OF CNS DISEASES ADAMED SP. Z O.O. (PL) 2014-11-13 US disclosed
US-8822517-B2 Arylosulfonamides for the treatment of CNS diseases ADAMED SP. Z O.O. (PL) 2014-09-02 US disclosed
EP-2616440-A1 ARYLOSULFONAMIDES FOR THE TREATMENT OF CNS DISEASES Adamed sp. z o.o. (PL) 2013-07-24 EP disclosed
US-20130172365-A1 ARYLOSULFONAMIDES FOR THE TREATMENT OF CNS DISEASES ADAMED SP. Z.O.O. (PL) 2013-07-04 US disclosed
WO-2012035123-A1 ARYLOSULFONAMIDES FOR THE TREATMENT OF CNS DISEASES ADAMED SP. Z O.O. (PL) 2012-03-22 WO disclosed
EP-2311824-A1 Heteroarylpiperidines, pyrrolidines and piperazines and their use as antipsychotics and analgetics Aventis Pharmaceuticals Inc. (US) 2011-04-20 EP disclosed
EP-0963984-B1 Heteroarylpiperidines and piperazines and their use as antipsychotics and analgetics AVENTIS PHARMA INC (US) 2009-03-18 EP disclosed
EP-0959076-B1 Heteroarylperidines and piperazines and their use as antipsychotics and analgetics AVENTIS PHARMA INC (US) 2007-03-07 EP disclosed
US-5554614-A TREATMENT OF PSYCHOLOGICAL DISORDERS, PSYCHOSES; ANALGESICS HOECHST-ROUSSEL PHARMACEUTICALS, INC. (US) 1996-09-10 US disclosed
US-5552414-A 1-(1H-indolyloxyalkyl)-4-(heteroaryl) piperidines and related compounds useful as antipsychotics and analgesics HOECHST-ROUSSEL PHARMACEUTICALS, INC. (US) 1996-09-03 US disclosed
US-5550130-A ANTIPSYCHOTIC AGENTS, ANALGESICS HOECHST-ROUSSEL PHARMACEUTICALS, INC. (US) 1996-08-27 US disclosed
WO-1995011680-A1 HETEROARYLPIPERIDINES, PYRROLIDINES AND PIPERAZINES AND THEIR USE AS ANTIPSYCHOTICS AND ANALGETICS HOECHST-ROUSSEL PHARMACEUTICALS INC. (US) 1995-05-04 WO disclosed
EP-0625978-A1 PIPERAZINE AND PIPERIDINE DERIVATIVES, AND THEIR USE AS ANTIPSYCHOTICS THE WELLCOME FOUNDATION LIMITED (GB) 1994-11-30 EP disclosed
US-5364866-A Side effect reduction HOECHST-ROUSSEL PHARMACEUTICALS, INC. (US) 1994-11-15 US disclosed
EP-0612318-A1 HETEROARYLPIPERIDINES, PYRROLIDINES AND PIPERAZINES AND THEIR USE AS ANTIPSYCHOTICS AND ANALGETICS HOECHST-ROUSSEL PHARMACEUTICALS INCORPORATED (US) 1994-08-31 EP disclosed
WO-1993016073-A1 PIPERAZINE AND PIPERIDINE DERIVATIVES, AND THEIR USE AS ANTIPSYCHOTICS THE WELLCOME FOUNDATION LIMITED (GB) 1993-08-19 WO disclosed
EP-0542136-A1 Heteroarylpiperidines, pyrrolidines and piperazines and their use as antipsychotics and analgetics HOECHST-ROUSSEL PHARMACEUTICALS INCORPORATED (US) 1993-05-19 EP disclosed
WO-1993009102-A1 HETEROARYLPIPERIDINES, PYRROLIDINES AND PIPERAZINES AND THEIR USE AS ANTIPSYCHOTICS AND ANALGETICS HOECHST-ROUSSEL PHARMACEUTICALS, INC. (US) 1993-05-13 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 (2 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-20140336200-A1 ARYLOSULFONAMIDES FOR THE TREATMENT OF CNS DISEASES ARSA, PMP22, STS DRD2 3216/4885HTR2A 1150/4885MCHR1 2160/4885
US-20130172365-A1 ARYLOSULFONAMIDES FOR THE TREATMENT OF CNS DISEASES ARSA, PMP22, STS DRD2 3216/4885HTR2A 1150/4885MCHR1 2160/4885

“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.