SCHEMBL4167565

SCHEMBL4167565

O=C(O)NCc1ccc(-c2nc3ccccc3s2)cn1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 6/20 0.57
NPC1 O15118 4/20 0.57
MAPT P10636 4/20 0.57
KDM4E B2RXH2 4/20 0.57
SMN1; SMN2 Q16637 1/20 0.57
KMT2A Q03164 4/20 0.54
MEN1 O00255 3/20 0.54
MMP9 P14780 2/20 0.51
MMP8 P22894 2/20 0.51
MMP2 P08253 1/20 0.51
MMP13 P45452 1/20 0.51
LMNA P02545 3/20 0.51
MGLL Q99685 2/20 0.51
NAMPT P43490 3/20 0.50
RXFP1 Q9HBX9 2/20 0.49
THRB P10828 1/20 0.49
ALDH1A1 P00352 3/20 0.49
GAA P10253 3/20 0.49
GLA P06280 1/20 0.49
APP P05067 1/20 0.49

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
SCHEMBL4166800 0.82 APP (0.65) RAB9ANPC1MAPTKDM4ESMN1; SMN2
SCHEMBL23706045 0.79 KDM4E (0.52) RAB9ANPC1MAPTKDM4ESMN1; SMN2
SCHEMBL2843471 0.78 LMNA (0.54) RAB9ANPC1SMN1; SMN2LMNAPOLB
SCHEMBL2100053 0.77 NPC1 (0.48) RAB9ANPC1MAPTKDM4ESMN1; SMN2
SCHEMBL2055239 0.76 APP (0.65) RAB9ANPC1MAPTKDM4ESMN1; SMN2
SCHEMBL19758229 0.76 NPC1 (0.59) RAB9ANPC1MAPTKDM4ESMN1; SMN2
SCHEMBL4168564 0.75 APP (0.49) RAB9ANPC1MAPTKDM4ESMN1; SMN2
SCHEMBL4167569 0.75 RAB9A (0.54) RAB9ANPC1MAPTKDM4ESMN1; SMN2
SCHEMBL2100058 0.75 PAX8 (0.56) RAB9ANPC1MAPTKDM4ESMN1; SMN2
SCHEMBL5089880 0.74 ALDH1A1 (0.51) RAB9ANPC1MAPTKDM4ESMN1; SMN2

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 5 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-20120207679-A1 Novel Heteroaryl Substituted Benzothiazoles ASTRAZENECA AB (SE) 2012-08-16 US disclosed
US-20090028787-A1 Novel Heteroaryl Substituted Benzothiazoles NAVIDEA BIOPHARMACEUTICALS, INC. 2009-01-29 US disclosed
EP-1981883-A1 NOVEL HETEROARYL SUBSTITUTED BENZOTHIAZOLES AstraZeneca AB (SE) 2008-10-22 EP 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 RAB9A 2522/4885NPC1 94/4885MAPT 2/4885
US-20120207679-A1 Novel Heteroaryl Substituted Benzothiazoles MAPT, APP, PSEN1 RAB9A 3260/4885NPC1 156/4885MAPT 1/4885

“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.