SCHEMBL4456863

SCHEMBL4456863

O=c1c2ccc(Cl)cc2n(Cc2cccnc2)c(=O)n1S(=O)(=O)c1ccc(Cl)cc1

nearest known ligand 0.53

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
GABRA5 P31644 5/20 0.53
GABRA1 P14867 4/20 0.53
KMT2A Q03164 2/20 0.50
PKM P14618 1/20 0.50
OPRM1 P35372 1/20 0.50
OPRD1 P41143 1/20 0.50
PARG Q86W56 3/20 0.44
MAPK8 P45983 1/20 0.43
MAPK9 P45984 1/20 0.43
CMA1 P23946 1/20 0.42
SRC P12931 1/20 0.42
MCL1 Q07820 3/20 0.42
GRIN1 Q05586 2/20 0.41
GRIN2B Q13224 2/20 0.41
LMNA P02545 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41

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
SCHEMBL7466124 0.88 CMA1 (0.46) GABRA5GABRA1PARGMAPK8MAPK9
SCHEMBL7460713 0.88 MAPK8 (0.55) KMT2AMAPK8MAPK9CMA1SRC
SCHEMBL7470753 0.84 NAMPT (0.55) KMT2ALMNASMN1; SMN2
SCHEMBL7461866 0.84 MEN1 (0.48) KMT2ALMNASMN1; SMN2
SCHEMBL7461329 0.82 CMA1 (0.46) KMT2APARGMAPK8MAPK9CMA1
SCHEMBL7467427 0.80 ALDH1A1 (0.47) GABRA5GABRA1KMT2APARGMAPK8
SCHEMBL7468043 0.80 MAPT (0.48) KMT2ALMNASMN1; SMN2
SCHEMBL7470273 0.80 CCR2 (0.47) KMT2APARGMAPK8MAPK9CMA1
SCHEMBL7472478 0.80 CCR2 (0.50) KMT2AMAPK8MAPK9CMA1SMN1; SMN2
SCHEMBL7468517 0.79 HDAC6 (0.52) KMT2AMAPK8MAPK9CMA1SMN1; 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 8 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090054319-A1 Methods and Compositions for the Treatment of Hypertension and Gastrointestinal Disorders MICROBIA, INC. (US) 2009-02-26 US disclosed
WO-2006102069-A2 METHODS AND COMPOSITIONS FOR THE TREATMENT OF HYPERTENSION AND GASTROINTESTINAL DISORDERS MICROBIA, INC. (US) 2006-09-28 WO disclosed
US-20040086537-A1 Prophylactic or threapeutic composition for ocular circulation disorders INOUE JUN (JP) 2004-05-06 US disclosed
EP-1224945-A1 TENSION-RELIEVING AGENTS FOR CILIARY MUSCLE Senju Pharmaceutical Co., Ltd. (JP) 2002-07-24 EP disclosed
EP-0795548-B1 QUINAZOLINE DERIVATIVES AND USE THEREOF SUNTORY LTD (JP) 2002-07-03 EP disclosed
EP-1112749-A2 PREVENTIVES OR REMEDIES FOR EYE CIRCULATORY FAILURE Senju Pharmaceutical Co., Ltd. (JP) 2001-07-04 EP disclosed
US-5814631-A CHYMASE INHIBITOR, CARDIVASCULAR SUNTORY LIMITED (JP) 1998-09-29 US disclosed
EP-0795548-A1 QUINAZOLINE DERIVATIVES AND USE THEREOF SUNTORY LIMITED (JP) 1997-09-17 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 (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-20040086537-A1 Prophylactic or threapeutic composition for ocular circulation disorders CMA1, THOP1, TPSAB1 GABRA5 2781/4885GABRA1 3048/4885KMT2A 4655/4885
US-20090054319-A1 Methods and Compositions for the Treatment of Hypertension and Gastrointestinal Disorders PTGIS, PTGIR, GRPR GABRA5 285/4885GABRA1 396/4885KMT2A 4822/4885

“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.