SCHEMBL2967274

SCHEMBL2967274

O=C(NCCCNc1nsc2ncccc12)c1cccnc1Cl

nearest known ligand 0.48

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
BRD4 O60885 1/20 0.44
SMN1; SMN2 Q16637 5/20 0.43
HPGD P15428 2/20 0.43
LMNA P02545 2/20 0.43
ALDH1A1 P00352 1/20 0.43
NPC1 O15118 2/20 0.43
POLB P06746 1/20 0.41
PTGS2 P35354 1/20 0.40
KMT2A Q03164 2/20 0.39
HTT P42858 1/20 0.39
RAB9A P51151 1/20 0.39
ATM Q13315 1/20 0.39

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
SCHEMBL2977056 0.85 POLB (0.46) SMN1; SMN2HPGDALDH1A1POLBKMT2A
SCHEMBL2963816 0.84 NPC1 (0.47) BRD4SMN1; SMN2NPC1KMT2ARAB9A
SCHEMBL2976741 0.83 CFTR (0.49) BRD4SMN1; SMN2HPGDLMNAALDH1A1
SCHEMBL2978905 0.81 HCRTR1 (0.40) BRD4ALDH1A1
SCHEMBL2962075 0.80 TP53BP1 (0.49) SMN1; SMN2KMT2A
SCHEMBL2967147 0.80 KMT2A (0.57) SMN1; SMN2HPGDALDH1A1NPC1KMT2A
SCHEMBL2979040 0.79 NAMPT (0.43) ALDH1A1KMT2ARAB9A
SCHEMBL2972800 0.79 KMT2A (0.50) HPGDLMNAALDH1A1NPC1KMT2A
SCHEMBL2973135 0.79 KMT2A (0.60) ALDH1A1KMT2A
SCHEMBL2979092 0.77 TRPV1 (0.50) HPGDALDH1A1NPC1KMT2ARAB9A

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 BRD4 101/4885SMN1; SMN2 4300/4885HPGD 1921/4885

“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.