SCHEMBL2976402

SCHEMBL2976402

COc1ccc(COc2ccc(C(=O)NCCCNc3nsc4ccccc34)cc2)cc1OC

nearest known ligand 0.57

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.53
LMNA P02545 2/20 0.53
POLB P06746 1/20 0.48
OPRM1 P35372 1/20 0.48
TMEM97 Q5BJF2 1/20 0.48
SIGMAR1 Q99720 1/20 0.48
TP53 P04637 3/20 0.47
MTNR1B P49286 1/20 0.46
SMN1; SMN2 Q16637 1/20 0.45

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
SCHEMBL2963804 0.90 TP53 (0.53) MAPTLMNAPOLBSIGMAR1TP53
SCHEMBL2977391 0.88 RAB9A (0.53) MAPTLMNAPOLBTP53SMN1; SMN2
SCHEMBL2970495 0.85 SMPD1 (0.58) MAPTLMNAPOLBTP53SMN1; SMN2
SCHEMBL2979156 0.84 HDAC3 (0.46) MAPTLMNATP53SMN1; SMN2
SCHEMBL2976625 0.82 RAB9A (0.55) MAPTLMNAPOLBTP53SMN1; SMN2
SCHEMBL13202704 0.81 SMPD1 (0.59) MAPTLMNAPOLBTP53SMN1; SMN2
SCHEMBL2966783 0.80 SMN1; SMN2 (0.51) MAPTLMNAPOLBTP53SMN1; SMN2
SCHEMBL2975993 0.80 KCNA3 (0.50) MAPTTP53
SCHEMBL2972727 0.79 MAPT (0.47) MAPTPOLBSIGMAR1TP53SMN1; SMN2
SCHEMBL2976509 0.79 PDE4D (0.60)

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 7 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
US-7776847-B2 Benzisothiazoles useful for treating or preventing HCV infection RIGEL PHARMACEUTICALS, INC. (US) 2010-08-17 US disclosed
US-20060229294-A1 Benzisothiazoles useful for treating or preventing HCV infection RIGEL PHARMACEUTICALS, INC. (US) 2006-10-12 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 (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 MAPT 2483/4885LMNA 4468/4885POLB 1347/4885

“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.