SCHEMBL2969561

SCHEMBL2969561

COC(=O)c1ccc(C(=O)NCCNc2nsc3ccccc23)nc1

nearest known ligand 0.46

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 2/20 0.46
TP53 P04637 4/20 0.45
KDM4E B2RXH2 1/20 0.44
L3MBTL1 Q9Y468 1/20 0.44
MAPT P10636 4/20 0.43
SMN1; SMN2 Q16637 2/20 0.43
CFTR P13569 1/20 0.39
KMT2A Q03164 2/20 0.38
MEN1 O00255 1/20 0.38
AHR P35869 1/20 0.38
LMNA P02545 1/20 0.38
KCNA3 P22001 1/20 0.38
EPAS1 Q99814 1/20 0.37

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
SCHEMBL2970395 0.88 TP53 (0.47) TP53KDM4EMAPTSMN1; SMN2KMT2A
SCHEMBL2966538 0.88 KMT2A (0.41) TP53KDM4EMAPTKMT2AMEN1
SCHEMBL2974715 0.88 TP53 (0.53) TP53MAPTSMN1; SMN2KMT2AMEN1
SCHEMBL2970768 0.86 GABRA5 (0.46) MAPK1TP53KDM4EL3MBTL1MAPT
SCHEMBL13220861 0.85 KMT2A (0.42) TP53MAPTSMN1; SMN2CFTRKMT2A
SCHEMBL2964388 0.83 HIF1A (0.45) MAPTKMT2AEPAS1
SCHEMBL2977041 0.82 TP53 (0.43) TP53KDM4EL3MBTL1MAPTSMN1; SMN2
SCHEMBL13220653 0.82 CFTR (0.39) TP53MAPTSMN1; SMN2CFTRKMT2A
SCHEMBL5321116 0.82 MAPK1 (0.44) MAPK1TP53KDM4EL3MBTL1MAPT
SCHEMBL13220646 0.81 HIF1A (0.37) TP53MAPTKMT2AEPAS1

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-1853573-A1 BENZISOTHIAZOLES USEFUL FOR TREATING OR PREVENTING HCV INFECTION Rigel Pharmaceuticals, Inc. (US) 2007-11-14 EP claimed
US-20060229294-A1 Benzisothiazoles useful for treating or preventing HCV infection RIGEL PHARMACEUTICALS, INC. (US) 2006-10-12 US claimed
WO-2006091858-A1 BENZISOTHIAZOLES USEFUL FOR TREATING OR PREVENTING HCV INFECTION RIGEL PHARMACEUTICALS, INC. (US) 2006-08-31 WO claimed
US-7776847-B2 Benzisothiazoles useful for treating or preventing HCV infection RIGEL PHARMACEUTICALS, INC. (US) 2010-08-17 US disclosed
US-7776847-B2 Benzisothiazoles useful for treating or preventing HCV infection RIGEL PHARMACEUTICALS, INC. (US) 2010-08-17 US disclosed
EP-1853573-A1 BENZISOTHIAZOLES USEFUL FOR TREATING OR PREVENTING HCV INFECTION Rigel Pharmaceuticals, Inc. (US) 2007-11-14 EP disclosed
US-20060229294-A1 Benzisothiazoles useful for treating or preventing HCV infection RIGEL PHARMACEUTICALS, INC. (US) 2006-10-12 US disclosed
WO-2006091858-A1 BENZISOTHIAZOLES USEFUL FOR TREATING OR PREVENTING HCV INFECTION RIGEL PHARMACEUTICALS, INC. (US) 2006-08-31 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-20060229294-A1 Benzisothiazoles useful for treating or preventing HCV infection HAVCR2, ZC3HAV1, MAVS MAPK1 1959/4885TP53 561/4885KDM4E 2196/4885

“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.