SCHEMBL4354737

SCHEMBL4354737

O=C1N=C(NCc2ccc(C(F)(F)F)cc2)S/C1=C/c1cccc(OCc2ccccc2)c1

nearest known ligand 0.51

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
PTPN1 P18031 7/20 0.51
ACP1 P24666 2/20 0.51
NR1H4 Q96RI1 2/20 0.50
MMP13 P45452 2/20 0.48
ADAMTS5 Q9UNA0 1/20 0.48
MEN1 O00255 2/20 0.46
KMT2A Q03164 2/20 0.46
MAOA P21397 1/20 0.46
MAOB P27338 1/20 0.46
PPARA Q07869 1/20 0.44
GFER P55789 1/20 0.44
MMP3 P08254 1/20 0.44
AKR1B1 P15121 1/20 0.44
CNR1 P21554 1/20 0.43
AURKA O14965 1/20 0.42
RPS6KB1 P23443 1/20 0.42
AURKB Q96GD4 1/20 0.42

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
SCHEMBL4354740 1.00 PTPN1 (0.51) PTPN1ACP1NR1H4MMP13ADAMTS5
SCHEMBL4351246 0.90 ADAMTS5 (0.51) PTPN1ACP1NR1H4MMP13ADAMTS5
SCHEMBL4351250 0.90 ADAMTS5 (0.51) PTPN1ACP1NR1H4MMP13ADAMTS5
SCHEMBL4355526 0.83 ALOX5 (0.51) PTPN1ACP1MMP13ADAMTS5MMP3
SCHEMBL4355527 0.83 ALOX5 (0.51) PTPN1ACP1MMP13ADAMTS5MMP3
SCHEMBL4354241 0.82 PTPN1 (0.45) PTPN1ACP1MEN1KMT2A
SCHEMBL4354245 0.82 PTPN1 (0.45) PTPN1ACP1MEN1KMT2A
SCHEMBL4363199 0.80 ALOX5 (0.44) MEN1KMT2AAKR1B1
SCHEMBL4363196 0.80 ALOX5 (0.44) MEN1KMT2AAKR1B1
SCHEMBL4350295 0.78 ALOX5 (0.52) PTPN1ACP1MMP13ADAMTS5MMP3

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
EP-1890695-B1 USE OF 2,5-DISUBSTITUTED THIAZOL-4-ONE DERIVATIVES IN DRUGS GRUENENTHAL GMBH (DE) 2013-02-20 EP claimed
US-20090215758-A1 Use of 2,5-Disubstituted Thiazol-4-One Derivatives in Drugs GRUENENTHAL GMBH (DE) 2009-08-27 US claimed
US-20090215758-A1 Use of 2,5-Disubstituted Thiazol-4-One Derivatives in Drugs GRUENENTHAL GMBH (DE) 2009-08-27 US 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-20090215758-A1 Use of 2,5-Disubstituted Thiazol-4-One Derivatives in Drugs ABCB1, ABCG2, SLC5A2 PTPN1 1096/4885ACP1 4133/4885NR1H4 492/4885

“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.