SCHEMBL7149512

SCHEMBL7149512

COc1ccc(C(=O)Nc2ccccc2)cc1NS(=O)(=O)c1ccc(Cl)c(Cl)c1

nearest known ligand 0.59

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 7/20 0.59
KDM4E B2RXH2 3/20 0.59
KMT2A Q03164 8/20 0.58
MAPT P10636 8/20 0.58
LMNA P02545 7/20 0.58
MEN1 O00255 6/20 0.58
HPGD P15428 1/20 0.58
ACLY P53396 1/20 0.56
SMN1; SMN2 Q16637 3/20 0.56
CPT1A P50416 3/20 0.55
CPT1B Q92523 3/20 0.55
PTGDR Q13258 1/20 0.54
PTGDR2 Q9Y5Y4 1/20 0.54
HTT P42858 2/20 0.54
MAPK1 P28482 2/20 0.53
L3MBTL1 Q9Y468 1/20 0.53
CPT2 P23786 1/20 0.53

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
SCHEMBL7144948 0.88 ALDH1A1 (0.67) ALDH1A1KDM4EKMT2AMAPTLMNA
SCHEMBL7152548 0.88 KMT2A (0.63) ALDH1A1KDM4EKMT2AMAPTLMNA
SCHEMBL7149822 0.87 ACLY (0.64) ALDH1A1KDM4EKMT2AMAPTLMNA
SCHEMBL7153167 0.87 ALDH1A1 (0.67) ALDH1A1KDM4EKMT2AMAPTLMNA
SCHEMBL7144730 0.86 KMT2A (0.72) ALDH1A1KDM4EKMT2AMAPTLMNA
SCHEMBL7150208 0.86 KMT2A (0.70) ALDH1A1KDM4EKMT2AMAPTLMNA
SCHEMBL7144933 0.86 ALDH1A1 (0.66) ALDH1A1KDM4EKMT2AMAPTLMNA
SCHEMBL7148203 0.85 CPT1A (0.62) ALDH1A1KDM4EKMT2AMAPTLMNA
SCHEMBL7150693 0.85 HTT (0.69) ALDH1A1KDM4EKMT2AMAPTLMNA
SCHEMBL7152081 0.85 ALDH1A1 (0.80) ALDH1A1KDM4EKMT2AMAPTLMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6528528-B2 Inhibitors of 15-lipoxygenase, inhibiting chemotaxis of monocytes WARNER-LAMBERT COMPANY 2003-03-04 US claimed
US-20010031874-A1 Thiourea and benzamide compounds, compositions and methods of treating or preventing inflammatory diseases and atherosclerosis CONNOR DAVID THOMAS (US) 2001-10-18 US claimed
EP-1042276-A1 THIOUREA COMPOUNDS, COMPOSITIONS AND METHODS OF TREATING OR PREVENTING INFLAMMATORY DISEASES AND ATHEROSCLEROSIS WARNER-LAMBERT COMPANY LLC (US) 2000-10-11 EP claimed
WO-1999032433-A1 THIOUREA AND BENZAMIDE COMPOUNDS, COMPOSITIONS AND METHODS OF TREATING OR PREVENTING INFLAMMATORY DISEASES AND ATHEROSCLEROSIS WARNER-LAMBERT COMPANY (US) 1999-07-01 WO claimed
US-6528528-B2 Inhibitors of 15-lipoxygenase, inhibiting chemotaxis of monocytes WARNER-LAMBERT COMPANY 2003-03-04 US disclosed
US-20010031874-A1 Thiourea and benzamide compounds, compositions and methods of treating or preventing inflammatory diseases and atherosclerosis CONNOR DAVID THOMAS (US) 2001-10-18 US disclosed
US-6268387-B1 INHIBITORS OF THE ENZYME 15-LIPOXYGENASE AND ARE INHIBITORS OF MONOCYTE CHEMOTAXIS. WARNER-LAMBERT COMPANY 2001-07-31 US disclosed
EP-1042276-A1 THIOUREA COMPOUNDS, COMPOSITIONS AND METHODS OF TREATING OR PREVENTING INFLAMMATORY DISEASES AND ATHEROSCLEROSIS WARNER-LAMBERT COMPANY LLC (US) 2000-10-11 EP disclosed
WO-1999032433-A1 THIOUREA AND BENZAMIDE COMPOUNDS, COMPOSITIONS AND METHODS OF TREATING OR PREVENTING INFLAMMATORY DISEASES AND ATHEROSCLEROSIS WARNER-LAMBERT COMPANY (US) 1999-07-01 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-20010031874-A1 Thiourea and benzamide compounds, compositions and methods of treating or preventing inflammatory diseases and atherosclerosis TPMT, CTH, CBS ALDH1A1 369/4885KDM4E 3150/4885KMT2A 1976/4885

“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.