SCHEMBL4086525

SCHEMBL4086525

CCOC(=O)c1sc(N2CCN(c3ccc(OC)cc3)CC2)nc1-c1ccccc1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DHODH Q02127 3/20 0.59
ALDH1A1 P00352 5/20 0.57
NPSR1 Q6W5P4 4/20 0.57
HTT P42858 1/20 0.57
HSD17B10 Q99714 1/20 0.55
ADORA3 P0DMS8 1/20 0.54
GAA P10253 2/20 0.54
HPGD P15428 1/20 0.53
MAPT P10636 3/20 0.52
MEN1 O00255 2/20 0.51
KMT2A Q03164 2/20 0.51
CDC7 O00311 1/20 0.51
DBF4 Q9UBU7 1/20 0.51
CYP1A2 P05177 1/20 0.51
CYP2C9 P11712 1/20 0.51
CYP2C19 P33261 1/20 0.51
LMNA P02545 4/20 0.51
TDP1 Q9NUW8 1/20 0.50
L3MBTL1 Q9Y468 1/20 0.50
TP53 P04637 1/20 0.50

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
SCHEMBL4630926 0.94 DHODH (0.54) DHODHALDH1A1NPSR1HTTHSD17B10
SCHEMBL347930 0.87 ALDH1A1 (0.63) ALDH1A1NPSR1HTTADORA3GAA
SCHEMBL4093773 0.85 ALDH1A1 (0.61) ALDH1A1NPSR1HTTADORA3GAA
SCHEMBL4093746 0.85 LMNA (0.57) DHODHALDH1A1NPSR1HTTHSD17B10
SCHEMBL4085482 0.82 AR (0.65) ALDH1A1NPSR1HTTHSD17B10ADORA3
SCHEMBL19909753 0.82 ALDH1A1 (0.62) DHODHALDH1A1NPSR1HTTHSD17B10
SCHEMBL347552 0.81 PTGDR2 (0.62) ALDH1A1NPSR1HTTADORA3GAA
SCHEMBL16597702 0.80 ALDH1A1 (0.50) DHODHALDH1A1NPSR1HTTHSD17B10
SCHEMBL348279 0.80 CETP (0.56) ALDH1A1NPSR1HTTADORA3GAA
SCHEMBL16039074 0.78 CDC7 (0.76) DHODHALDH1A1HSD17B10HPGDMEN1

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-20090221604-A1 Thiazole Compounds and Their Use as PGD2 Antagonists ARGENTA DISCOVERY LIMITED (GB) 2009-09-03 US disclosed
EP-1922312-A1 THIAZOLE COMPOUNDS AND THEIR USE AS PGD2 ANTAGONISTS Argenta Discovery Limited (GB) 2008-05-21 EP disclosed
WO-2007028999-A1 THIAZOLE COMPOUNDS AND THEIR USE AS PGD2 ANTAGONISTS ARGENTA DISCOVERY LIMITED (GB) 2007-03-15 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-20090221604-A1 Thiazole Compounds and Their Use as PGD2 Antagonists PTGDR2, PTGDR, PTGER2 DHODH 992/4885ALDH1A1 3327/4885NPSR1 116/4885

“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.