SCHEMBL2965486

SCHEMBL2965486

COc1ccc(CNS(=O)(=O)c2ccc3snc(NCCCN)c3c2)cc1

nearest known ligand 0.50

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 7/20 0.47
LMNA P02545 2/20 0.46
CYP19A1 P11511 1/20 0.44
TSHR P16473 2/20 0.43
SMN1; SMN2 Q16637 2/20 0.43
HTT P42858 1/20 0.43
KDM4E B2RXH2 1/20 0.43
MAPK1 P28482 1/20 0.43
ILK Q13418 1/20 0.43
GAA P10253 1/20 0.41
MAPT P10636 1/20 0.41
RECQL P46063 1/20 0.41
USP2 O75604 1/20 0.41
TP53 P04637 1/20 0.41
PKM P14618 1/20 0.40

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
SCHEMBL2969558 0.84 KMT2A (0.51) ALDH1A1TSHRHTTKDM4EGAA
SCHEMBL2964331 0.80 ALDH1A1 (0.54) ALDH1A1LMNACYP19A1TSHRSMN1; SMN2
SCHEMBL2965708 0.75 ALDH1A1 (0.55) ALDH1A1SMN1; SMN2USP2PKM
SCHEMBL3058234 0.74 EPAS1 (0.54) ALDH1A1SMN1; SMN2USP2PKM
SCHEMBL13202843 0.74 CHRM2 (0.48) KDM4E
SCHEMBL2977758 0.73 CHRM2 (0.47) ALDH1A1LMNATSHRKDM4EMAPK1
SCHEMBL2977843 0.73 ALDH1A1 (0.52) ALDH1A1SMN1; SMN2USP2PKM
SCHEMBL2967150 0.72 CFTR (0.44) ALDH1A1SMN1; SMN2MAPTTP53
SCHEMBL2971174 0.72 KDM4E (0.38) ALDH1A1LMNASMN1; SMN2KDM4EMAPT
SCHEMBL2979055 0.72 EPAS1 (0.48) ALDH1A1LMNATSHRSMN1; SMN2HTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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
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 ALDH1A1 227/4885LMNA 4468/4885CYP19A1 2234/4885

“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.