SCHEMBL5163876

SCHEMBL5163876

CCCC(Oc1cccc(C(=N)N)c1)C(=O)Nc1ccc(N2CCCC2=O)c(C)c1

nearest known ligand 0.45

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
F10 P00742 14/20 0.45
PRSS1 P07477 3/20 0.44
PLAU P00749 2/20 0.39
HPN P05981 1/20 0.38
ALDH1A1 P00352 1/20 0.38
HSD17B10 Q99714 1/20 0.38
POLB P06746 1/20 0.37
GAA P10253 1/20 0.37

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
SCHEMBL5163949 0.98 F10 (0.48) F10PRSS1PLAUHPNPOLB
SCHEMBL5164416 0.98 F10 (0.48) F10PRSS1PLAUHPNPOLB
SCHEMBL5164832 0.97 F10 (0.47) F10PRSS1PLAUHPNPOLB
SCHEMBL5167890 0.97 F10 (0.47) F10PRSS1PLAUHPNPOLB
SCHEMBL5166099 0.92 F10 (0.49) F10PRSS1PLAUALDH1A1POLB
SCHEMBL5165742 0.91 F10 (0.52) F10PRSS1PLAUHPNALDH1A1
SCHEMBL5166255 0.91 F10 (0.46) F10PRSS1PLAUHPNALDH1A1
SCHEMBL5166428 0.89 F10 (0.40) F10PRSS1ALDH1A1HSD17B10POLB
SCHEMBL5164085 0.89 F10 (0.47) F10PRSS1PLAUPOLB
SCHEMBL5165335 0.89 F10 (0.51) F10PRSS1PLAUALDH1A1POLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7273867-B2 Phenyl derivatives MERCK PATENT GMBH (DE) 2007-09-25 US claimed
EP-1351938-B1 PHENYL DERIVATIVES MERCK PATENT GMBH (DE) 2007-04-11 EP claimed
US-20040087582-A1 Phenyl derivatives MERCK PATENT GESELLSCHAFT (DE) 2004-05-06 US claimed
US-7273867-B2 Phenyl derivatives MERCK PATENT GMBH (DE) 2007-09-25 US disclosed
EP-1351938-B1 PHENYL DERIVATIVES MERCK PATENT GMBH (DE) 2007-04-11 EP disclosed
US-20040087582-A1 Phenyl derivatives MERCK PATENT GESELLSCHAFT (DE) 2004-05-06 US 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-20040087582-A1 Phenyl derivatives F2, F11, SERPINC1 F10 6/4885PRSS1 88/4885PLAU 223/4885

“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.