SCHEMBL790804

SCHEMBL790804

O=S(=O)(NCCCN1CCN(c2cccc3c2OCCO3)CC1)c1cccc(F)c1

nearest known ligand 0.57

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
HTR1A P08908 7/20 0.57
DRD4 P21917 2/20 0.55
ADRA1A P35348 2/20 0.55
HTR1D P28221 1/20 0.55
HTR2B P41595 1/20 0.55
HTR7 P34969 1/20 0.54
DRD2 P14416 3/20 0.53
ADRA1D P25100 1/20 0.51
ADRA1B P35368 1/20 0.51
DRD3 P35462 1/20 0.51

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
SCHEMBL790850 0.97 HTR1A (0.61) HTR1ADRD4ADRA1AHTR1DHTR2B
SCHEMBL792717 0.90 HTR1A (0.64) HTR1ADRD4ADRA1AHTR1DHTR2B
SCHEMBL791927 0.90 HTR7 (0.58) HTR1ADRD4ADRA1AHTR1DHTR2B
SCHEMBL791213 0.89 DRD2 (0.57) HTR1AHTR7DRD2
SCHEMBL791666 0.89 L3MBTL1 (0.58) HTR1AHTR7
SCHEMBL792716 0.89 CCR1 (0.53) HTR1ADRD4ADRA1AHTR7DRD2
SCHEMBL792618 0.87 HTR1A (0.57) HTR1ADRD4ADRA1AHTR1DHTR2B
SCHEMBL790903 0.87 HTR7 (0.55) HTR1ADRD4ADRA1AHTR7DRD2
SCHEMBL792132 0.86 L3MBTL1 (0.62) HTR1ADRD2
SCHEMBL791311 0.86 DRD2 (0.58) HTR1AHTR2BHTR7DRD2

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 9 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2616440-A1 ARYLOSULFONAMIDES FOR THE TREATMENT OF CNS DISEASES Adamed sp. z o.o. (PL) 2013-07-24 EP claimed
US-20130172365-A1 ARYLOSULFONAMIDES FOR THE TREATMENT OF CNS DISEASES ADAMED SP. Z.O.O. (PL) 2013-07-04 US claimed
WO-2012035123-A1 ARYLOSULFONAMIDES FOR THE TREATMENT OF CNS DISEASES ADAMED SP. Z O.O. (PL) 2012-03-22 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

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 HTR1A 1354/4885DRD4 3761/4885ADRA1A 2795/4885
US-20130172365-A1 ARYLOSULFONAMIDES FOR THE TREATMENT OF CNS DISEASES ARSA, PMP22, STS HTR1A 1354/4885DRD4 3761/4885ADRA1A 2795/4885

“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.