SCHEMBL4582297

SCHEMBL4582297

COC(=O)c1cccc(NC(=S)NC2CCN(c3ccnc4ccc(Cl)cc34)CC2)c1

nearest known ligand 0.51

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.47
MEN1 O00255 2/20 0.47
KMT2A Q03164 2/20 0.47
ALDH1A1 P00352 1/20 0.47
GAA P10253 1/20 0.47
PDGFRB P09619 1/20 0.47
NPC1 O15118 2/20 0.46
RAB9A P51151 1/20 0.46
CNR1 P21554 1/20 0.45
LMNA P02545 1/20 0.45
BPTF Q12830 1/20 0.45

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
SCHEMBL4725481 0.94 PDGFRB (0.42) MAPTMEN1KMT2AALDH1A1GAA
SCHEMBL4581838 0.93 KDM4E (0.49) MAPTMEN1KMT2AALDH1A1GAA
SCHEMBL4582512 0.91 MEN1 (0.53) MEN1KMT2APDGFRB
SCHEMBL4726676 0.88 KDM4E (0.45) MAPTMEN1KMT2AALDH1A1
SCHEMBL4583177 0.88 MEN1 (0.56) MEN1KMT2APDGFRBLMNA
SCHEMBL4583852 0.87 PDGFRB (0.49) PDGFRB
SCHEMBL4582617 0.86 MAPT (0.49) MAPTMEN1KMT2AALDH1A1NPC1
SCHEMBL4583521 0.85 PDGFRB (0.55) MAPTALDH1A1PDGFRBLMNA
SCHEMBL4583908 0.84 MEN1 (0.47) MEN1KMT2APDGFRB
SCHEMBL4584601 0.84 MEN1 (0.44) MEN1KMT2APDGFRB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080125435-A1 1-(Het)aryl-3-[hetaryl-piperidin-4-yl]-thioureas as modulators of the EP2 receptor BAYER SCHERING PHARMA AG (DE) 2008-05-29 US claimed
EP-1903037-A1 1-(hetero)aryl-3-[heteroaryl-piperidin-4yl]-thiourea derivatives as modulators of EP2 receptors Bayer Schering Pharma Aktiengesellschaft (DE) 2008-03-26 EP claimed
US-20080125435-A1 1-(Het)aryl-3-[hetaryl-piperidin-4-yl]-thioureas as modulators of the EP2 receptor BAYER SCHERING PHARMA AG (DE) 2008-05-29 US disclosed
EP-1903037-A1 1-(hetero)aryl-3-[heteroaryl-piperidin-4yl]-thiourea derivatives as modulators of EP2 receptors Bayer Schering Pharma Aktiengesellschaft (DE) 2008-03-26 EP disclosed
WO-2008028690-A1 1-(HET)ARYL-3-[HETARYL-PIPERIDIN-4-YL]-THIOUREAS AS MODULATORS OF THE EP2 RECEPTOR BAYER SCHERING PHARMA AKTIENGESELLSCHAFT (DE) 2008-03-13 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-20080125435-A1 1-(Het)aryl-3-[hetaryl-piperidin-4-yl]-thioureas as modulators of the EP2 receptor PTGER2, PTGER1, PTGES2 MAPT 4796/4885MEN1 4553/4885KMT2A 2513/4885

“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.