SCHEMBL6959526

SCHEMBL6959526

CC(=O)c1cccc(NS(=O)(=O)c2ccc(C)cc2)c1

nearest known ligand 0.75

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TCF4 P15884 1/20 0.75
CTNNB1 P35222 1/20 0.75
ALDH1A1 P00352 5/20 0.72
MAPT P10636 4/20 0.72
SMN1; SMN2 Q16637 3/20 0.72
MEN1 O00255 3/20 0.72
KMT2A Q03164 3/20 0.72
LMNA P02545 2/20 0.72
NPSR1 Q6W5P4 1/20 0.72
HPGD P15428 1/20 0.68
CA12 O43570 2/20 0.61
CA9 Q16790 2/20 0.61
NOD2 Q9HC29 1/20 0.61
CYP1A2 P05177 1/20 0.61
CYP3A4 P08684 1/20 0.61
CYP2D6 P10635 1/20 0.61
CYP2C9 P11712 1/20 0.61
CYP2C19 P33261 1/20 0.61
HTT P42858 1/20 0.61
RECQL P46063 1/20 0.61

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
SCHEMBL30926644 0.88 MAPT (0.72) TCF4CTNNB1ALDH1A1MAPTSMN1; SMN2
SCHEMBL27181232 0.88 MAPT (0.72) TCF4CTNNB1ALDH1A1MAPTSMN1; SMN2
SCHEMBL11025715 0.88 POLB (0.78) TCF4CTNNB1ALDH1A1MAPTMEN1
SCHEMBL2941161 0.88 CA12 (0.69) TCF4CTNNB1ALDH1A1MAPTSMN1; SMN2
SCHEMBL15840563 0.87 MAPT (0.64) TCF4CTNNB1ALDH1A1MAPTSMN1; SMN2
SCHEMBL4928453 0.87 TCF4 (0.73) TCF4CTNNB1ALDH1A1MAPTSMN1; SMN2
SCHEMBL23093353 0.87 HTR6 (0.66) TCF4CTNNB1ALDH1A1MAPTSMN1; SMN2
SCHEMBL2234179 0.87 SMN1; SMN2 (0.81) TCF4CTNNB1ALDH1A1MAPTSMN1; SMN2
SCHEMBL21802493 0.87 CYP19A1 (0.69) TCF4CTNNB1ALDH1A1MAPTSMN1; SMN2
SCHEMBL16116948 0.86 TCF4 (1.00) TCF4CTNNB1ALDH1A1MAPTSMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9469606-B2 Wnt/b-catenin inhibitors and methods of use THE GENERAL HOSPITAL CORPORATION (US) 2016-10-18 US disclosed
US-20140288174-A1 WNT/B-CATENIN INHIBITORS AND METHODS OF USE THE GENERAL HOSPITAL CORPORATION 2014-09-25 US disclosed
EP-0729465-B1 PYRONE DERIVATIVES AS PROTEASE INHIBITORS AND ANTIVIRAL AGENTS PARKE DAVIS & CO (US) 2003-01-22 EP disclosed
US-6005103-A TREATMENT OF BACTERIAL AND VIRAL INFECTIONS AND DISEASES, INCLUDING AIDS WARNER-LAMBERT COMPANY (US) 1999-12-21 US disclosed
US-5808062-A AIDS THERAPY WARNER-LAMBERT COMPANY (US) 1998-09-15 US disclosed
EP-0729465-A1 PYRONE DERIVATIVES AS PROTEASE INHIBITORS AND ANTIVIRAL AGENTS PARKE, DAVIS & COMPANY (US) 1996-09-04 EP disclosed
EP-0729466-A1 PYRONE DERIVATIVES AS PROTEASE INHIBITORS AND ANTIVIRAL AGENTS PARKE, DAVIS & COMPANY (US) 1996-09-04 EP disclosed
WO-1995014013-A1 PYRONE DERIVATIVES AS PROTEASE INHIBITORS AND ANTIVIRAL AGENTS PARKE, DAVIS & COMPANY (US) 1995-05-26 WO disclosed
WO-1995014014-A2 PYRONE DERIVATIVES AS PROTEASE INHIBITORS AND ANTIVIRAL AGENTS PARKE, DAVIS & COMPANY (US) 1995-05-26 WO disclosed
US-4521422-A ANTICONVULSANT, ANTIEPILEPTIC AGENTS, SEDATIVES, MUSCLE RELAXANTS AMERICAN CYANAMID COMPANY (US) 1985-06-04 US disclosed
EP-0129847-A2 Aryl and heteroaryl[7-(aryl and heteroaryl)-pyrazolo-[1,5-a]-pyrimidin-3-yl]methanones AMERICAN CYANAMID COMPANY (US) 1985-01-02 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 (1 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-20140288174-A1 WNT/B-CATENIN INHIBITORS AND METHODS OF USE WNT1, WNT3A, CTNNB1 TCF4 551/4885CTNNB1 3/4885ALDH1A1 4315/4885

“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.