SCHEMBL4584132

SCHEMBL4584132

CSc1ccccc1NC(=O)N(S)C1CCN(c2nccc3ccccc23)CC1

nearest known ligand 0.46

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
HCAR2 Q8TDS4 1/20 0.46
MALT1 Q9UDY8 2/20 0.44
HRH4 Q9H3N8 1/20 0.43
HTR2C P28335 1/20 0.41
SORD Q00796 2/20 0.39
MEN1 O00255 1/20 0.39
KMT2A Q03164 1/20 0.39
PHGDH O43175 1/20 0.38
PAK1 Q13153 1/20 0.38
ACACB O00763 1/20 0.37
DPP4 P27487 2/20 0.37
DPP7 Q9UHL4 1/20 0.37
FAAH O00519 1/20 0.36
LMNA P02545 1/20 0.36
ALDH1A1 P00352 1/20 0.36

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
SCHEMBL4582077 0.86 MALT1 (0.47) HCAR2MALT1HRH4HTR2CSORD
SCHEMBL4582824 0.84 HCAR2 (0.48) HCAR2MALT1HRH4HTR2CSORD
SCHEMBL4584085 0.84 MALT1 (0.49) HCAR2MALT1HRH4HTR2CSORD
SCHEMBL4584341 0.84 MALT1 (0.47) HCAR2MALT1HRH4MEN1KMT2A
SCHEMBL4581748 0.82 UBE2M (0.44) HCAR2MALT1HRH4HTR2CSORD
SCHEMBL4583159 0.80 MALT1 (0.54) HCAR2MALT1HRH4PAK1ACACB
SCHEMBL4583964 0.80 LMNA (0.39) KMT2AFAAHLMNAALDH1A1
SCHEMBL4584127 0.80 HTT (0.56) HCAR2MALT1HRH4HTR2CSORD
SCHEMBL4583179 0.79 ALDH1A1 (0.40) MALT1MEN1KMT2ALMNAALDH1A1
SCHEMBL4583105 0.79 CYP1A2 (0.48) MALT1MEN1KMT2APAK1LMNA

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 4 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

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 HCAR2 39/4885MALT1 628/4885HRH4 44/4885

“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.