SCHEMBL4585182

SCHEMBL4585182

Cc1ccccc1NC(=S)NC1CCN(c2ccnc3c(Cl)cccc23)CC1

nearest known ligand 0.53

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.53
SMN1; SMN2 Q16637 2/20 0.50
POLB P06746 1/20 0.48
PKM P14618 1/20 0.46
LMNA P02545 1/20 0.44
GAA P10253 1/20 0.44
ALOX12 P18054 1/20 0.44

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
SCHEMBL4581737 0.92 ALDH1A1 (0.54) ALDH1A1SMN1; SMN2POLBPKMLMNA
SCHEMBL4583282 0.89 PKM (0.56) ALDH1A1SMN1; SMN2POLBPKM
SCHEMBL4583173 0.89 HTT (0.52) ALDH1A1SMN1; SMN2POLBPKM
SCHEMBL4583234 0.89 ALDH1A1 (0.46) ALDH1A1SMN1; SMN2POLBPKMLMNA
SCHEMBL4582720 0.86 ALDH1A1 (0.50) ALDH1A1POLBLMNA
SCHEMBL4583245 0.85 POLB (0.51) ALDH1A1SMN1; SMN2POLB
SCHEMBL4583208 0.84 ALDH1A1 (0.42) ALDH1A1SMN1; SMN2PKM
SCHEMBL4582154 0.82 ALDH1A1 (0.52) ALDH1A1PKM
SCHEMBL4583992 0.82 ALDH1A1 (0.52) ALDH1A1LMNA
SCHEMBL4582417 0.82 MEN1 (0.55) LMNA

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 ALDH1A1 866/4885SMN1; SMN2 4338/4885POLB 4413/4885

“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.