SCHEMBL634483

SCHEMBL634483

CCC(OC)(C(=O)O)c1nc(C)cs1

nearest known ligand 0.39

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
SSTR4 P31391 1/20 0.36
ALDH1A1 P00352 2/20 0.35
KDM4E B2RXH2 2/20 0.35
CNR2 P34972 2/20 0.34
POLB P06746 2/20 0.34
NPC1 O15118 2/20 0.33
RAB9A P51151 2/20 0.33
LMNA P02545 3/20 0.33
GAA P10253 1/20 0.33
MAPT P10636 1/20 0.33
PPARA Q07869 1/20 0.32
TSHR P16473 2/20 0.32
L3MBTL1 Q9Y468 1/20 0.32
MAPK1 P28482 1/20 0.32
MAPK10 P53779 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32

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
SCHEMBL13151426 0.76 SSTR4 (0.41) SSTR4ALDH1A1KDM4ECNR2NPC1
SCHEMBL132212 0.72 SSTR4 (0.44) SSTR4ALDH1A1POLBNPC1RAB9A
SCHEMBL633518 0.72 SSTR4 (0.38) SSTR4ALDH1A1CNR2NPC1RAB9A
SCHEMBL13151611 0.70 SSTR4 (0.43) SSTR4ALDH1A1POLBNPC1RAB9A
SCHEMBL13151418 0.70 SSTR4 (0.43) SSTR4ALDH1A1KDM4EPOLBNPC1
SCHEMBL634381 0.69 SSTR4 (0.40) SSTR4ALDH1A1CNR2NPC1RAB9A
SCHEMBL31294721 0.68 SSTR4 (0.42) SSTR4ALDH1A1CNR2NPC1RAB9A
SCHEMBL633274 0.68 SSTR4 (0.39) SSTR4ALDH1A1CNR2POLBNPC1
SCHEMBL633680 0.68 SSTR4 (0.39) SSTR4ALDH1A1CNR2NPC1RAB9A
SCHEMBL21587853 0.68 SMN1; SMN2 (0.40) SSTR4ALDH1A1KDM4ECNR2POLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120095064-A1 (PYRAZOL-3-YL)-1,3,4-THIADIAZOL-2-AMINE AND (PYRAZOL-3-YL)-1,3,4-THIAZOL-2-AMINE COMPOUNDS GLAXO GROUP LIMITED (GB) 2012-04-19 US disclosed
EP-2419426-A1 ( PYRAZOL-3-YL) -1, 3, 4-THIADIAZOL-2-AMINE AND ( PYRAZOL-3-YL) -1, 3, 4-THIAZOL-2-AMINE COMPOUNDS Glaxo Group Limited (GB) 2012-02-22 EP 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-20120095064-A1 (PYRAZOL-3-YL)-1,3,4-THIADIAZOL-2-AMINE AND (PYRAZOL-3-YL)-1,3,4-THIAZOL-2-AMINE COMPOUNDS H1-3, CHRM2, TBL3 SSTR4 2701/4885ALDH1A1 2718/4885KDM4E 2509/4885

“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.