SCHEMBL2967289

SCHEMBL2967289

O=C(NCCNc1nsc2ccccc12)c1cccnc1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 5/20 0.52
KMT2A Q03164 5/20 0.52
NPC1 O15118 2/20 0.52
RAB9A P51151 2/20 0.52
SMN1; SMN2 Q16637 2/20 0.52
EPHX2 P34913 3/20 0.51
CYP2C9 P11712 3/20 0.50
CYP2C19 P33261 3/20 0.50
ALDH1A1 P00352 2/20 0.49
THRB P10828 1/20 0.49
CFTR P13569 1/20 0.48
USP2 O75604 1/20 0.47
CYP3A4 P08684 2/20 0.47
CYP1A2 P05177 1/20 0.47
NAMPT P43490 1/20 0.47
MAPT P10636 2/20 0.46
HTR1A P08908 1/20 0.46
DRD2 P14416 1/20 0.46
HTR2A P28223 1/20 0.46
DRD3 P35462 1/20 0.46

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
SCHEMBL2974074 0.88 HTR1A (0.51) KMT2ASMN1; SMN2ALDH1A1CFTRMAPT
SCHEMBL2977368 0.84 KMT2A (0.52) MEN1KMT2ASMN1; SMN2CYP2C19CFTR
SCHEMBL2968325 0.83 KCNA3 (0.49) KMT2AALDH1A1MAPTHTR1ADRD2
SCHEMBL2973242 0.82 MAPT (0.45) SMN1; SMN2ALDH1A1MAPTHTR1ADRD2
SCHEMBL2968393 0.82 KCNA3 (0.50) KMT2AEPHX2ALDH1A1MAPTHTR1A
SCHEMBL2963364 0.81 MAPT (0.51) MEN1KMT2ASMN1; SMN2ALDH1A1MAPT
SCHEMBL2976082 0.81 MAPT (0.44) SMN1; SMN2ALDH1A1MAPTHTR1ADRD2
SCHEMBL2971364 0.81 TP53BP1 (0.46) MEN1KMT2ASMN1; SMN2ALDH1A1MAPT
SCHEMBL2969680 0.81 CDK4 (0.50) EPHX2ALDH1A1MAPTHTR1ADRD2
SCHEMBL2978627 0.81 MEN1 (0.52) MEN1KMT2ASMN1; SMN2NAMPTHTR1A

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 9 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
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 MEN1 4684/4885KMT2A 2900/4885NPC1 242/4885

“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.