SCHEMBL4205644

SCHEMBL4205644

CCCC[Sn](CCCC)(CCCC)c1sc(NC(C)=O)nc1C

nearest known ligand 0.49

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.49
HPGD P15428 1/20 0.49
PI4KB Q9UBF8 3/20 0.44
RXFP1 Q9HBX9 1/20 0.43
PIK3CG P48736 8/20 0.41
PIK3CD O00329 2/20 0.41
PIK3CA P42336 2/20 0.41
PIK3CB P42338 2/20 0.41
NPC1 O15118 2/20 0.41
RAB9A P51151 2/20 0.41
POLB P06746 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
TSHR P16473 1/20 0.40
LMNA P02545 1/20 0.39
MAPK1 P28482 1/20 0.39
LCK P06239 1/20 0.39

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
SCHEMBL22532336 0.90 TSHR (0.41) ALDH1A1HPGDPI4KBRXFP1NPC1
SCHEMBL25389524 0.82 LCK (0.46) ALDH1A1PI4KBTSHRLCK
SCHEMBL4301296 0.71 CDK2 (0.46) SMN1; SMN2LMNA
SCHEMBL24599388 0.70 ALDH1A1 (0.48) ALDH1A1HPGDPI4KBRXFP1PIK3CG
SCHEMBL12620553 0.70 ALDH1A1 (0.58) ALDH1A1HPGDPI4KBRXFP1PIK3CG
SCHEMBL924824 0.70 ALDH1A1 (0.53) ALDH1A1HPGDRXFP1PIK3CGPIK3CD
SCHEMBL155142 0.69 RAB9A (0.57) ALDH1A1HPGDRXFP1PIK3CGPIK3CD
SCHEMBL24599484 0.69 ALDH1A1 (0.46) ALDH1A1HPGDPI4KBRXFP1PIK3CG
SCHEMBL15939461 0.69 ALDH1A1 (0.46) ALDH1A1HPGDPI4KBRXFP1PIK3CG
SCHEMBL21552109 0.68 PDE2A (0.35)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090029997-A1 Thiazole Derivatives and Use Thereof LABORATOIRES SERONO SA (CH) 2009-01-29 US disclosed
EP-1979346-A1 THIAZOLE DERIVATIVES AND USE THEREOF LABORATOIRES SERONO S.A. (CH) 2008-10-15 EP disclosed
WO-2007082956-A1 THIAZOLE DERIVATIVES AND USE THEREOF LABORATOIRES SERONO S.A. (CH) 2007-07-26 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-20090029997-A1 Thiazole Derivatives and Use Thereof PDGFRB, PDGFRA, TEC ALDH1A1 174/4885HPGD 2130/4885PI4KB 1755/4885

“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.