SCHEMBL7222716

SCHEMBL7222716

CCCCS(=O)(=O)Nc1ccc(Oc2cccc3ccccc23)cc1OC

nearest known ligand 0.54

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MRGPRX1 Q96LB2 3/20 0.54
KDR P35968 1/20 0.52
MAPT P10636 1/20 0.45
MEN1 O00255 1/20 0.44
KMT2A Q03164 1/20 0.44
LMNA P02545 1/20 0.43
HPGD P15428 1/20 0.43
HSD17B10 Q99714 1/20 0.43
RAD52 P43351 1/20 0.43
NCOA3 Q9Y6Q9 1/20 0.43
PARP14 Q460N5 1/20 0.41
PTGS1 P23219 1/20 0.41
BRD4 O60885 1/20 0.41
AR P10275 1/20 0.40

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
SCHEMBL7219476 0.82 MRGPRX1 (0.52) MRGPRX1
SCHEMBL8307237 0.82 AR (0.56) MRGPRX1KDRMAPTMEN1KMT2A
SCHEMBL7228467 0.76 KDM4E (0.54) MRGPRX1KDRMAPTMEN1KMT2A
SCHEMBL8301095 0.76 RAD52 (0.53) MRGPRX1KDRRAD52NCOA3PARP14
SCHEMBL7227793 0.74 MRGPRX1 (0.45) MRGPRX1MAPTMEN1KMT2ALMNA
SCHEMBL9447086 0.74 MRGPRX1 (0.56) MRGPRX1KDRKMT2APTGS1AR
SCHEMBL23014682 0.72 ALDH1A1 (0.57) MRGPRX1
SCHEMBL5393321 0.72 ALDH1A1 (0.57) MRGPRX1
SCHEMBL7222256 0.72 BRD4 (0.47) MRGPRX1KDRLMNAHPGDHSD17B10
SCHEMBL7220116 0.72 BCL2L1 (0.48) KDRMEN1KMT2ALMNABRD4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6573278-B2 For therapy and prophylaxis of cerebral apoplexy and craniocerebral trauma BAYER AKTIENGESELLSCHAFT (DE) 2003-06-03 US disclosed
EP-0966436-B1 ARYL SULFONAMIDES AND ANALOGUES THEREOF AND THEIR USE IN THE TREATMENT OF NEURODEGENERATIVE DISEASES BAYER AG (DE) 2002-12-11 EP disclosed
US-20020072529-A1 Arylsulfonamides and analogues BAYER INTELLECTUAL PROPERTY GMBH (DE) 2002-06-13 US disclosed
EP-0966436-A1 ARYL SULFONAMIDES AND ANALOGUES THEREOF AND THEIR USE IN THE TREATMENT OF NEURODEGENERATIVE DISEASES Bayer Aktiengesellschaft (DE) 1999-12-29 EP disclosed
WO-1998037061-A1 ARYL SULFONAMIDES AND ANALOGUES THEREOF AND THEIR USE IN THE TREATMENT OF NEURODEGENERATIVE DISEASES BAYER AKTIENGESELLSCHAFT (DE) 1998-08-27 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 (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-20020072529-A1 Arylsulfonamides and analogues ARSA, PRSS12, SNCA MRGPRX1 1609/4885KDR 4017/4885MAPT 405/4885

“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.