SCHEMBL5524015

SCHEMBL5524015

CCc1cc(C(=O)OC)ccc1-c1ccccc1S(=O)(=O)N(COC)c1noc(C)c1C

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.37
SMN1; SMN2 Q16637 2/20 0.37
CYP1A2 P05177 1/20 0.37
CYP2C19 P33261 1/20 0.37
MAPT P10636 3/20 0.36
MEN1 O00255 3/20 0.36
KMT2A Q03164 3/20 0.36
NPSR1 Q6W5P4 2/20 0.36
USP2 O75604 2/20 0.36
LMNA P02545 1/20 0.36
ALDH1A1 P00352 3/20 0.35
ALOX12 P18054 1/20 0.35
EDNRA P25101 6/20 0.35
GPBAR1 Q8TDU6 1/20 0.35
TP53 P04637 1/20 0.34
HCRTR1 O43613 1/20 0.34
HPGD P15428 1/20 0.34
TDP1 Q9NUW8 1/20 0.34
AGTR1 P30556 2/20 0.33
POLB P06746 1/20 0.33

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
SCHEMBL5521626 0.91 MEN1 (0.36) TSHRSMN1; SMN2CYP1A2CYP2C19MAPT
SCHEMBL31498370 0.88 MAPT (0.38) TSHRSMN1; SMN2MAPTMEN1KMT2A
SCHEMBL30757386 0.88 TSHR (0.34) TSHRSMN1; SMN2CYP1A2CYP2C19MAPT
SCHEMBL26688901 0.88 TSHR (0.34) TSHRSMN1; SMN2CYP1A2CYP2C19MAPT
SCHEMBL535263 0.88 MAPT (0.38) TSHRSMN1; SMN2MAPTMEN1KMT2A
SCHEMBL29001525 0.86 EDNRA (0.38) TSHRSMN1; SMN2CYP1A2CYP2C19MAPT
SCHEMBL30171242 0.86 EDNRA (0.38) TSHRSMN1; SMN2CYP1A2CYP2C19MAPT
SCHEMBL5521669 0.86 EDNRA (0.36) MAPTEDNRATP53AGTR1
SCHEMBL31498369 0.85 EDNRA (0.38) MEN1KMT2AALDH1A1EDNRATDP1
SCHEMBL31498371 0.85 EDNRA (0.38) MEN1KMT2AALDH1A1EDNRATDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1741713-A2 Biphenyl sulfonamides as dual angiotensin endothelin receptor antagonists Bristol-Myers Squibb Company (US) 2007-01-10 EP disclosed
EP-1237888-B1 BIPHENYL SULFONAMIDES AS DUAL ANGIOTENSIN ENDOTHELIN RECEPTOR ANTAGONISTS BRISTOL MYERS SQUIBB CO (US) 2006-09-13 EP disclosed
US-6852745-B2 Biphenyl sulfonamides as dual angiotensin endothelin receptor antagonists BRISTOL-MYERS SQUIBB COMPANY (US) 2005-02-08 US disclosed
US-6835741-B2 Biphenyl sulfonamides as dual angiotensin endothelin receptor antagonists BRISTOL-MYERS SQUIBB COMPANY 2004-12-28 US disclosed
US-20040127515-A1 Biphenyl sulfonamides as dual angiotensin endothelin receptor antagonists PHARMACOPEIA, LLC 2004-07-01 US disclosed
US-20040106833-A1 Biphenyl sulfonamides as dual angiotensin endothelin receptor antagonists PHARMACOPEIA, LLC 2004-06-03 US disclosed
US-6638937-B2 As antihypertensive agents; for therapy of disorders related to renal, glomerular and mesangial cell function; therapy of endotoxemia or endotoxin shock as well as hemorrhagic shock; useful in alleviation of pain associated cancer BRISTOL-MYERS SQUIBB CO. 2003-10-28 US disclosed
US-20020143024-A1 Biphenyl sulfonamides as dual angiotensin endothelin receptor antagonists PHARMACOPEIA, LLC 2002-10-03 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 (3 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-20040127515-A1 Biphenyl sulfonamides as dual angiotensin endothelin receptor antagonists EDNRB, AGTR2, EDNRA TSHR 238/4885SMN1; SMN2 3448/4885CYP1A2 555/4885
US-20020143024-A1 Biphenyl sulfonamides as dual angiotensin endothelin receptor antagonists EDNRB, AGTR2, EDNRA TSHR 238/4885SMN1; SMN2 3448/4885CYP1A2 555/4885
US-20040106833-A1 Biphenyl sulfonamides as dual angiotensin endothelin receptor antagonists EDNRB, AGTR2, EDNRA TSHR 238/4885SMN1; SMN2 3448/4885CYP1A2 555/4885

“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.