SCHEMBL4352670

SCHEMBL4352670

O=C(NC1=NC(=O)C(=Cc2ccc(C(F)(F)F)cc2)S1)Nc1ccc(C(F)(F)F)cc1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EPHX2 P34913 3/20 0.52
PIM1 P11309 1/20 0.45
PIM2 Q9P1W9 1/20 0.45
MAPT P10636 3/20 0.43
CA12 O43570 1/20 0.43
CA1 P00915 1/20 0.43
CA2 P00918 1/20 0.43
CA9 Q16790 1/20 0.43
BAZ1A Q9NRL2 1/20 0.42
MTOR P42345 1/20 0.42
MEN1 O00255 3/20 0.41
KMT2A Q03164 3/20 0.41
RAB9A P51151 2/20 0.41
HTT P42858 1/20 0.41
TGM2 P21980 1/20 0.41
MAOB P27338 1/20 0.41
NAMPT P43490 1/20 0.41
TRPV1 Q8NER1 1/20 0.41
ALDH1A1 P00352 2/20 0.41
KDM4E B2RXH2 1/20 0.41

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
SCHEMBL4352665 1.00 EPHX2 (0.52) EPHX2PIM1PIM2MAPTCA12
SCHEMBL4352758 0.94 EPHX2 (0.47) EPHX2PIM1PIM2MAPTMEN1
SCHEMBL4352759 0.94 EPHX2 (0.47) EPHX2PIM1PIM2MAPTMEN1
SCHEMBL4351703 0.85 MEN1 (0.43) PIM1PIM2MAPTMEN1KMT2A
SCHEMBL4351701 0.85 MEN1 (0.43) PIM1PIM2MAPTMEN1KMT2A
SCHEMBL4128685 0.79 PIM1 (0.41) PIM1PIM2ALOX5
SCHEMBL4634822 0.79 PIM1 (0.41) PIM1PIM2ALOX5
Acetic Acid SCHEMBL4120755 0.76 ALOX5 (0.40) PIM1PIM2ALOX5
Acetic Acid SCHEMBL4120750 0.76 ALOX5 (0.40) PIM1PIM2ALOX5
SCHEMBL4351318 0.75 ALDH1A1 (0.47) MAPTMEN1KMT2ARAB9AALDH1A1

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 EPHX2 2906/4885PIM1 695/4885PIM2 294/4885

“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.