SCHEMBL12710004

SCHEMBL12710004

O=C(/C=C/c1c(C(F)(F)F)nc2sccn12)c1cccs1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 12/20 0.45
MEN1 O00255 10/20 0.45
KMT2A Q03164 10/20 0.45
TP53 P04637 9/20 0.45
MAPK1 P28482 6/20 0.45
ALDH1A1 P00352 10/20 0.43
HPGD P15428 8/20 0.43
CYP3A4 P08684 6/20 0.43
HSD17B10 Q99714 6/20 0.43
KDM4E B2RXH2 5/20 0.43
TDP1 Q9NUW8 2/20 0.43
GAA P10253 2/20 0.43
ALOX15 P16050 1/20 0.43
NPC1 O15118 4/20 0.42
RAB9A P51151 4/20 0.42
NFKB1 P19838 1/20 0.42
NFKB2 Q00653 1/20 0.42
RELA Q04206 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.42
RAF1 P04049 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
SCHEMBL13388312 1.00 MAPT (0.45) MAPTMEN1KMT2ATP53MAPK1
SCHEMBL13388073 0.84 PFKFB3 (0.43) MAPTMAPK1ALDH1A1HPGDSMN1; SMN2
SCHEMBL13388076 0.84 PFKFB3 (0.43) MAPTMAPK1ALDH1A1HPGDSMN1; SMN2
SCHEMBL13387797 0.82 MAPT (0.47) MAPTMEN1KMT2ATP53MAPK1
SCHEMBL12710006 0.82 MAPT (0.47) MAPTMEN1KMT2ATP53MAPK1
SCHEMBL13551646 0.82 MEN1 (0.53) MAPTMEN1KMT2ATP53MAPK1
SCHEMBL13388526 0.81 CYP1A1 (0.41) HSD17B10
SCHEMBL13388482 0.81 MAOB (0.48) MAPTKMT2ANPC1RAB9AL3MBTL1
SCHEMBL12709989 0.81 RAB9A (0.41) MAPTMEN1KMT2AMAPK1ALDH1A1
SCHEMBL12709789 0.81 CYP1A1 (0.41) HSD17B10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8916711-B2 Imidazothiazole-chalcone derivatives as potential anticancer agents and process for the preparation thereof COUNCIL OF SCIENTIFIC AND INDUSTRIAL RESEARCH (IN) 2014-12-23 US claimed
US-20120271054-A1 IMIDAZOTHIAZOLE-CHALCONE DERIVATIVES AS POTENTIAL ANTICANCER AGENTS AND PROCESS FOR THE PREPARATION THEREOF COUNCIL OF SCIENTIFIC AND INDUSTRIAL RESEARCH (IN) 2012-10-25 US claimed
US-8916711-B2 Imidazothiazole-chalcone derivatives as potential anticancer agents and process for the preparation thereof COUNCIL OF SCIENTIFIC AND INDUSTRIAL RESEARCH (IN) 2014-12-23 US disclosed
US-8916711-B2 Imidazothiazole-chalcone derivatives as potential anticancer agents and process for the preparation thereof COUNCIL OF SCIENTIFIC AND INDUSTRIAL RESEARCH (IN) 2014-12-23 US disclosed
EP-2488533-B1 IMIDAZOTHIAZOLE-CHALCONE DERIVATIVES AS POTENTIAL ANTICANCER AGENTS AND PROCESS FOR THE PREPARATION THEREOF COUNCIL SCIENT IND RES (IN) 2014-07-23 EP disclosed
EP-2488533-B1 IMIDAZOTHIAZOLE-CHALCONE DERIVATIVES AS POTENTIAL ANTICANCER AGENTS AND PROCESS FOR THE PREPARATION THEREOF COUNCIL SCIENT IND RES (IN) 2014-07-23 EP disclosed
US-20120271054-A1 IMIDAZOTHIAZOLE-CHALCONE DERIVATIVES AS POTENTIAL ANTICANCER AGENTS AND PROCESS FOR THE PREPARATION THEREOF COUNCIL OF SCIENTIFIC AND INDUSTRIAL RESEARCH (IN) 2012-10-25 US disclosed
US-20120271054-A1 IMIDAZOTHIAZOLE-CHALCONE DERIVATIVES AS POTENTIAL ANTICANCER AGENTS AND PROCESS FOR THE PREPARATION THEREOF COUNCIL OF SCIENTIFIC AND INDUSTRIAL RESEARCH (IN) 2012-10-25 US disclosed
WO-2011045646-A1 IMIDAZOTHIAZOLE-CHALCONE DERIVATIVES AS POTENTIAL ANTICANCER AGENTS AND PROCESS FOR THE PREPARATION THEREOF COUNCIL OF SCIENTIFIC & INDUSTRIAL RESEARCH (IN) 2011-04-21 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-20120271054-A1 IMIDAZOTHIAZOLE-CHALCONE DERIVATIVES AS POTENTIAL ANTICANCER AGENTS AND PROCESS FOR THE PREPARATION THEREOF EIF4A1, CYP2C18, UGT2B17 MAPT 3057/4885MEN1 2545/4885KMT2A 1313/4885

“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.