SCHEMBL5757134

SCHEMBL5757134

Cc1ccc(C(=O)NCc2ccc3c(c2)CCO3)c(=O)n1-c1cccc(C#N)c1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 2/20 0.48
ELANE P08246 1/20 0.47
NPC1 O15118 1/20 0.43
POLB P06746 1/20 0.43
KLKB1 P03952 2/20 0.42
KLK1 P06870 2/20 0.42
CHRM4 P08173 1/20 0.41
AURKA O14965 1/20 0.41
RPS6KB1 P23443 1/20 0.41
MAPT P10636 1/20 0.40
NOTUM Q6P988 1/20 0.39
OGA O60502 1/20 0.39
TP53 P04637 1/20 0.39
EGLN1 Q9GZT9 1/20 0.38
CASP3 P42574 1/20 0.38
CASP7 P55210 1/20 0.38
ALDH1A1 P00352 2/20 0.37
KDM4E B2RXH2 1/20 0.37
TSHR P16473 1/20 0.37
HSD17B10 Q99714 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
SCHEMBL5754303 0.87 HTT (0.49) ELANEMAPTALDH1A1KDM4ETSHR
SCHEMBL5758430 0.86 ELANE (0.65) RAB9AELANENPC1POLBCHRM4
SCHEMBL5758255 0.83 ELANE (0.51) ELANEKLKB1KLK1NOTUMALDH1A1
SCHEMBL5756911 0.83 ELANE (0.57) ELANEPOLBKLKB1KLK1MAPT
SCHEMBL5756216 0.83 ELANE (0.51) ELANEKLKB1KLK1NOTUMTP53
SCHEMBL5756141 0.82 ELANE (0.52) ELANEPOLBKLKB1KLK1MAPT
SCHEMBL5757705 0.82 ELANE (0.55) ELANEKLKB1KLK1NOTUMALDH1A1
SCHEMBL5756777 0.82 ELANE (0.54) ELANEKLKB1KLK1NOTUM
SCHEMBL5761223 0.81 ELANE (0.55) ELANEKLKB1KLK1MAPTNOTUM
SCHEMBL5756660 0.81 ELANE (0.55) ELANEKLKB1KLK1MAPTNOTUM

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1562902-B1 2-PYRIDONE DERIVATIVES AS INHIBITORS OF NEUTROPHILE ELASTASE ASTRAZENECA AB (SE) 2006-05-03 EP disclosed
US-20060035938-A1 2-Pyridone derivatives as inhibitors of neutrophile elastase ASRAZENECA AB (SE) 2006-02-16 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-20060035938-A1 2-Pyridone derivatives as inhibitors of neutrophile elastase SERPINB1, ELANE, SERPINE1 RAB9A 2158/4885ELANE 2/4885NPC1 3743/4885

“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.