SCHEMBL678897

SCHEMBL678897

CNc1cc(NS(=O)(=O)c2ccc(N)cc2)nc(NC)n1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
HTR6 P50406 9/20 1.00
MAPT P10636 4/20 1.00
ALDH1A1 P00352 4/20 1.00
CYP3A4 P08684 3/20 1.00
CYP2C9 P11712 3/20 1.00
CYP2C19 P33261 3/20 1.00
RAB9A P51151 1/20 1.00
KDM4E B2RXH2 1/20 0.97
APEX1 P27695 1/20 0.97
BLM P54132 1/20 0.97
NPSR1 Q6W5P4 1/20 0.97
PDE4A P27815 1/20 0.59
AGO2 Q9UKV8 1/20 0.59
SMN1; SMN2 Q16637 2/20 0.56
TDP1 Q9NUW8 1/20 0.56
LMNA P02545 3/20 0.54
ADRA1A P35348 1/20 0.54
L3MBTL1 Q9Y468 2/20 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
Hydrochloric Acid SCHEMBL8054947 0.99 MAPT (1.00) HTR6MAPTALDH1A1CYP3A4CYP2C9
SCHEMBL7835971 0.91 HTR6 (0.83) HTR6MAPTALDH1A1CYP3A4CYP2C9
SCHEMBL7835135 0.90 HTR6 (1.00) HTR6MAPTALDH1A1CYP3A4CYP2C9
SCHEMBL7834367 0.88 HTR6 (0.78) HTR6MAPTALDH1A1CYP3A4CYP2C9
SCHEMBL7826353 0.88 HTR6 (0.78) HTR6MAPTALDH1A1CYP3A4CYP2C9
SCHEMBL7833565 0.88 HTR6 (0.78) HTR6MAPTALDH1A1CYP3A4CYP2C9
SCHEMBL7837390 0.87 HTR6 (0.78) HTR6MAPTALDH1A1CYP3A4CYP2C9
SCHEMBL7836254 0.87 HTR6 (0.76) HTR6MAPTALDH1A1CYP3A4CYP2C9
SCHEMBL7834630 0.86 HTR6 (0.76) HTR6MAPTALDH1A1CYP3A4CYP2C9
Hydrochloric Acid SCHEMBL8055897 0.86 MAPT (0.78) HTR6MAPTALDH1A1CYP3A4CYP2C9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20250032503-A1 USE OF APREPITANT FOR TREATING ALZHEIMER'S DISEASE HOTH THERAPEUTICS, INC. 2025-01-30 US claimed
US-20220146492-A1 CELL MEMBRANE PERMEABILITY RESTORING THERAPY SHINE IAN BASIL (US) 2022-05-12 US claimed
EP-3953000-A1 CELL MEMBRANE PERMEABILITY RESTORING THERAPY Shine, Ian Basil (US) 2022-02-16 EP claimed
US-10898516-B2 Compositions and methods of treating diabetic retinopathy CASE WESTERN UNIVERSITY (US) 2021-01-26 US claimed
US-10568851-B2 Compounds and methods of treating ocular disorders CASE WESTERN RESERVE UNIVERSITY (US) 2020-02-25 US claimed
US-20190255102-A1 COMPOSITIONS AND METHODS OF TREATING DIABETIC RETINOPATHY CASE WESTERN UNIVERSITY 2019-08-22 US claimed
US-10272106-B2 Compositions and methods of treating diabetic retinopathy CASE WESTERN RESERVE UNIVERSITY (US) 2019-04-30 US claimed
EP-3151818-A1 COMPOSITIONS AND METHODS OF TREATING DIABETIC RETINOPATHY Case Western Reserve University (US) 2017-04-12 EP claimed
WO-2015187942-A1 COMPOSITIONS AND METHODS OF TREATING DIABETIC RETINOPATHY CASE WESTERN RESERVE UNIVERSITY (US) 2015-12-10 WO claimed
US-20140235562-A1 COMPOUNDS AND METHODS OF TREATING OCULAR DISORDERS CASE WESTERN RESERVE UNIVERSITY 2014-08-21 US claimed
WO-2013063269-A2 COMPOUNDS AND METHODS OF TREATING OCULAR DISORDERS CASE WESTERN RESERVE UNIVERSITY (US) 2013-05-02 WO claimed
EP-1799306-B1 COMPOSITIONS AND METHODS FOR TREATING COGNITIVE DISORDERS HOFFMANN LA ROCHE (CH) 2011-02-23 EP claimed
EP-1971334-A2 COMBINATION OF ACHE INHIBITOR AND 5-HT6 ANTAGONIST FOR THE TREATMENT OF COGNITIVE DYSFUNCTION Wyeth a Corporation of the State of Delaware (US) 2008-09-24 EP claimed
WO-2007087151-A2 COMBINATION OF ACHE INHIBITOR AND 5-HT6 ANTAGONIST FOR THE TREATMENT OF COGNITIVE DYSFUNCTION WYETH (US) 2007-08-02 WO claimed
US-20070167431-A1 Method for the treatment of cognitive dysfunction WYETH (US) 2007-07-19 US claimed
EP-1799306-A2 COMPOSITIONS AND METHODS FOR TREATING COGNITIVE DISORDERS F. Hoffmann-Roche AG (CH) 2007-06-27 EP claimed
WO-2006037482-A2 COMPOSITIONS AND METHODS FOR TREATING COGNITIVE DISORDERS F. HOFFMANN-LA ROCHE AG (CH) 2006-04-13 WO claimed
US-20060069094-A1 Compositions and methods for treating cognitive disorders ROCHE PALO ALTO LLC 2006-03-30 US claimed
EP-0815861-B1 Sulphonamides and their use HOFFMANN LA ROCHE (CH) 2001-09-19 EP claimed
EP-0815861-A1 Sulphonamides and their use F. HOFFMANN-LA ROCHE AG (CH) 1998-01-07 EP 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 (8 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-20140235562-A1 COMPOUNDS AND METHODS OF TREATING OCULAR DISORDERS ALDH1A2, TXNRD2, TXNRD1 HTR6 1889/4885MAPT 689/4885ALDH1A1 607/4885
US-20060069094-A1 Compositions and methods for treating cognitive disorders HTR6, HTR2A, HTR2C HTR6 1/4885MAPT 381/4885ALDH1A1 3003/4885
US-20190255102-A1 COMPOSITIONS AND METHODS OF TREATING DIABETIC RETINOPATHY GPR119, ARRB1, GRK1 HTR6 783/4885MAPT 2830/4885ALDH1A1 647/4885
US-10272106-B2 Compositions and methods of treating diabetic retinopathy GPR119, ARRB1, GRK1 HTR6 783/4885MAPT 2830/4885ALDH1A1 647/4885
US-20070167431-A1 Method for the treatment of cognitive dysfunction ACHE, BCHE, HTR6 HTR6 3/4885MAPT 285/4885ALDH1A1 1244/4885
US-20250032503-A1 USE OF APREPITANT FOR TREATING ALZHEIMER'S DISEASE TACR1, ACHE, TACR2 HTR6 376/4885MAPT 377/4885ALDH1A1 687/4885
US-10568851-B2 Compounds and methods of treating ocular disorders ALDH1A2, TXNRD2, TXNRD1 HTR6 1889/4885MAPT 689/4885ALDH1A1 607/4885
US-10898516-B2 Compositions and methods of treating diabetic retinopathy GPR119, ARRB1, GRK1 HTR6 783/4885MAPT 2830/4885ALDH1A1 647/4885

“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.