SCHEMBL426459

SCHEMBL426459

N#Cc1cccc(-c2cc(C(=O)N3CNC(=O)C3)sc2-c2cc(F)cc(Cl)c2)c1

nearest known ligand 0.39

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MAPK14 Q16539 1/20 0.39
EIF4A3 P38919 1/20 0.35
METAP2 P50579 1/20 0.34
PTGDR2 Q9Y5Y4 2/20 0.33
RIPK1 Q13546 1/20 0.33
KCNK3 O14649 2/20 0.33
TP53 P04637 1/20 0.33
MAPT P10636 1/20 0.33
HSD17B3 P37058 1/20 0.33
SLC6A9 P48067 2/20 0.32
KCNH2 Q12809 2/20 0.32
CSNK1E P49674 1/20 0.32
BRD4 O60885 1/20 0.32
BRD2 P25440 1/20 0.32
PGR P06401 1/20 0.32
SLC6A7 Q99884 1/20 0.32
HCRTR1 O43613 1/20 0.32
HCRTR2 O43614 1/20 0.32
PAX8 Q06710 1/20 0.31

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
SCHEMBL421761 0.93 PGR (0.39) MAPK14EIF4A3PTGDR2RIPK1TP53
SCHEMBL424682 0.90 PTGDR2 (0.38) MAPK14EIF4A3PTGDR2TP53MAPT
SCHEMBL422736 0.90 MAPK14 (0.41) MAPK14RIPK1TP53MAPTHCRTR1
SCHEMBL421766 0.87 MAPK14 (0.39) MAPK14PTGDR2KCNK3PGR
SCHEMBL422505 0.86 MAPK14 (0.41) MAPK14CSNK1EPGR
SCHEMBL424281 0.84 MAPK14 (0.42) MAPK14RIPK1BRD4PGR
SCHEMBL12942148 0.83 KCNK3 (0.36) METAP2PTGDR2KCNK3HCRTR1HCRTR2
SCHEMBL423833 0.82 MAPK14 (0.37) MAPK14RIPK1HSD17B3HCRTR1HCRTR2
SCHEMBL424176 0.82 MAPK14 (0.37) MAPK14RIPK1HSD17B3HCRTR1HCRTR2
SCHEMBL10109877 0.81 MAPK14 (0.39) MAPK14TP53MAPTSLC6A7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8546438-B2 Substituted (thiophenyl-carbonyl)imidazolidinones, and use thereof BAYER SCHERING PHARMA AKTIENGESELLSCHAFT (DE) 2013-10-01 US disclosed
US-8546438-B2 Substituted (thiophenyl-carbonyl)imidazolidinones, and use thereof BAYER SCHERING PHARMA AKTIENGESELLSCHAFT (DE) 2013-10-01 US disclosed
US-8546438-B2 Substituted (thiophenyl-carbonyl)imidazolidinones, and use thereof BAYER SCHERING PHARMA AKTIENGESELLSCHAFT (DE) 2013-10-01 US disclosed
EP-2376482-B1 SUBSTITUTED (THIOPHENYL-CARBONYL)IMIDAZOLIDINONES, AND USE THEREOF AICURIS GMBH & CO KG (DE) 2013-03-06 EP disclosed
US-20120022123-A1 SUBSTITUTED (THIOPHENYL-CARBONYL)IMIDAZOLIDINONES, AND USE THEREOF AICURIS GMBH & CO. KG (DE) 2012-01-26 US disclosed
US-20120022123-A1 SUBSTITUTED (THIOPHENYL-CARBONYL)IMIDAZOLIDINONES, AND USE THEREOF AICURIS GMBH & CO. KG (DE) 2012-01-26 US disclosed
US-20120022123-A1 SUBSTITUTED (THIOPHENYL-CARBONYL)IMIDAZOLIDINONES, AND USE THEREOF AICURIS GMBH & CO. KG (DE) 2012-01-26 US disclosed
WO-2010075962-A1 SUBSTITUTED (THIOPHENYL-CARBONYL)IMIDAZOLIDINONES, AND USE THEREOF AICURIS GMBH & CO. KG (DE) 2010-07-08 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-20120022123-A1 SUBSTITUTED (THIOPHENYL-CARBONYL)IMIDAZOLIDINONES, AND USE THEREOF TPMT, MAVS, EIF2AK2 MAPK14 2294/4885EIF4A3 491/4885METAP2 1210/4885

“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.