SCHEMBL2967098

SCHEMBL2967098

O=C(NCCCNc1nsc2ccccc12)c1ccc(Cl)cc1Cl

nearest known ligand 0.59

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.59
POLB P06746 2/20 0.52
TMEM97 Q5BJF2 2/20 0.51
SIGMAR1 Q99720 2/20 0.51
THRB P10828 1/20 0.48
RECQL P46063 1/20 0.48
TDP1 Q9NUW8 1/20 0.48
L3MBTL1 Q9Y468 1/20 0.48
HPGD P15428 1/20 0.47
NPC1 O15118 1/20 0.46
LMNA P02545 1/20 0.46
RAB9A P51151 1/20 0.46
SMN1; SMN2 Q16637 1/20 0.46
HDAC3 O15379 1/20 0.45
HDAC1 Q13547 1/20 0.45
ALDH1A1 P00352 1/20 0.43
DHODH Q02127 1/20 0.43
MAPT P10636 1/20 0.43

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
SCHEMBL2971168 0.94 KMT2A (0.53) KMT2APOLBTMEM97SIGMAR1THRB
SCHEMBL2962211 0.84 TP53 (0.51) TMEM97SIGMAR1MAPT
SCHEMBL2969557 0.83 KMT2A (0.49) KMT2APOLBNPC1LMNARAB9A
SCHEMBL2977842 0.83 KMT2A (0.44) KMT2AL3MBTL1HPGDNPC1LMNA
SCHEMBL2977520 0.82 KDM4E (0.47) KMT2APOLBHPGDNPC1LMNA
SCHEMBL2978103 0.80 HDAC1 (0.52) TMEM97SIGMAR1HDAC3HDAC1
SCHEMBL2971272 0.80 MAPT (0.42) KMT2AL3MBTL1NPC1RAB9AALDH1A1
SCHEMBL2977605 0.79 LMNA (0.52) KMT2APOLBL3MBTL1HPGDNPC1
SCHEMBL2975460 0.79 SMN1; SMN2 (0.60) KMT2ASMN1; SMN2HDAC3HDAC1ALDH1A1
SCHEMBL2969728 0.78 KMT2A (0.43) KMT2A

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 KMT2A 2900/4885POLB 1347/4885TMEM97 1109/4885

“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.