SCHEMBL2055201

SCHEMBL2055201

CS(=O)(=O)Nc1ccc2nc(-c3ccc(N4CCNCC4)nc3)sc2c1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NTRK1 P04629 4/20 0.51
TP53 P04637 1/20 0.47
CYP1A2 P05177 2/20 0.46
USP2 O75604 1/20 0.46
LMNA P02545 1/20 0.46
CYP3A4 P08684 1/20 0.46
MAPK1 P28482 1/20 0.46
CLK4 Q9HAZ1 1/20 0.46
CDK5 Q00535 1/20 0.45
CDK5R1 Q15078 1/20 0.45
CYP2D6 P10635 1/20 0.44
APP P05067 1/20 0.44
PTK2 Q05397 1/20 0.44
KCNH2 Q12809 1/20 0.43
CACNA1C Q13936 1/20 0.43
ASIC3 Q9UHC3 1/20 0.43
GAA P10253 2/20 0.42
NMT1 P30419 1/20 0.42
DYRK1A Q13627 1/20 0.42
RIPK2 O43353 2/20 0.41

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
SCHEMBL2098355 0.82 DDB1 (0.46) TP53APPKDM4ENPC1RAB9A
SCHEMBL2055191 0.79 MAPT (0.54) TP53APPGAAKDM4EALDH1A1
SCHEMBL27756723 0.79 NFKB1 (0.53) TP53LMNAAPPKCNH2GAA
SCHEMBL2055187 0.79 APP (0.58) APPGAAGLA
SCHEMBL7485675 0.77 GAA (0.64) NTRK1CYP1A2USP2LMNACYP3A4
SCHEMBL30307834 0.77 GAA (0.64) NTRK1CYP1A2USP2LMNACYP3A4
SCHEMBL2099417 0.77 ALDH1A1 (0.56) CYP1A2LMNACYP3A4CDK5CDK5R1
SCHEMBL2055265 0.77 TP53 (0.54) TP53LMNAAPPGAADYRK1A
SCHEMBL2055261 0.76 APP (0.56) APPMAPT
SCHEMBL2055195 0.75 NPC1 (0.46) TP53APPGAANMT1DYRK1A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8957215-B2 Heteroaryl substituted benzothiazoles NAVIDEA BIOPHARMACEUTICALS, INC. (US) 2015-02-17 US disclosed
US-8957215-B2 Heteroaryl substituted benzothiazoles NAVIDEA BIOPHARMACEUTICALS, INC. (US) 2015-02-17 US disclosed
US-20120207679-A1 Novel Heteroaryl Substituted Benzothiazoles ASTRAZENECA AB (SE) 2012-08-16 US disclosed
US-20120207679-A1 Novel Heteroaryl Substituted Benzothiazoles ASTRAZENECA AB (SE) 2012-08-16 US disclosed
US-8163928-B2 Heteroaryl substituted benzothiazoles ASTRAZENECA AB (SE) 2012-04-24 US disclosed
US-8163928-B2 Heteroaryl substituted benzothiazoles ASTRAZENECA AB (SE) 2012-04-24 US disclosed
US-8163928-B2 Heteroaryl substituted benzothiazoles ASTRAZENECA AB (SE) 2012-04-24 US disclosed
US-20090028787-A1 Novel Heteroaryl Substituted Benzothiazoles NAVIDEA BIOPHARMACEUTICALS, INC. 2009-01-29 US disclosed
US-20090028787-A1 Novel Heteroaryl Substituted Benzothiazoles NAVIDEA BIOPHARMACEUTICALS, INC. 2009-01-29 US disclosed
US-20090028787-A1 Novel Heteroaryl Substituted Benzothiazoles NAVIDEA BIOPHARMACEUTICALS, INC. 2009-01-29 US disclosed
WO-2007086800-A1 NOVEL HETEROARYL SUBSTITUTED BENZOTHIAZOLES ASTRAZENECA AB (SE) 2007-08-02 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 (2 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-20090028787-A1 Novel Heteroaryl Substituted Benzothiazoles APP, MAPT, PSEN1 NTRK1 2171/4885TP53 3053/4885CYP1A2 627/4885
US-20120207679-A1 Novel Heteroaryl Substituted Benzothiazoles MAPT, APP, PSEN1 NTRK1 1895/4885TP53 2392/4885CYP1A2 1073/4885

“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.