SCHEMBL5757111

SCHEMBL5757111

Cc1cc(CNC(=O)c2ccc(C)n(-c3cccc(C#N)c3)c2=O)no1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ELANE P08246 5/20 0.45
NOTUM Q6P988 1/20 0.43
PDE10A Q9Y233 1/20 0.41
KLKB1 P03952 1/20 0.39
KLK1 P06870 1/20 0.39
NPC1 O15118 1/20 0.39
RAB9A P51151 1/20 0.39
CNR1 P21554 1/20 0.38
ABCB1 P08183 1/20 0.38
PTGER1 P34995 1/20 0.38
ADORA2A P29274 1/20 0.36
ADORA1 P30542 1/20 0.36
CYP1A2 P05177 1/20 0.36
CYP2D6 P10635 1/20 0.36
CYP2C19 P33261 1/20 0.36
NSD2 O96028 1/20 0.36
NAMPT P43490 1/20 0.35
EPHX2 P34913 1/20 0.35
ALDH1A1 P00352 1/20 0.35
LMNA P02545 1/20 0.35

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
SCHEMBL5760743 0.84 ELANE (0.63) ELANENOTUMPDE10AALDH1A1LMNA
SCHEMBL5760215 0.83 HPGD (0.47) ELANENOTUMKLKB1KLK1RAB9A
SCHEMBL5759285 0.83 ELANE (0.46) ELANENOTUMPDE10AKLKB1KLK1
SCHEMBL5757705 0.82 ELANE (0.55) ELANENOTUMKLKB1KLK1CNR1
SCHEMBL5759880 0.82 PDE10A (0.40) ELANENOTUMPDE10ANPC1RAB9A
SCHEMBL5757136 0.82 ELANE (0.45) ELANENOTUMKLKB1KLK1NSD2
SCHEMBL5757781 0.82 ELANE (0.53) ELANENOTUMKLKB1KLK1PTGER1
SCHEMBL5756911 0.82 ELANE (0.57) ELANENOTUMPDE10AKLKB1KLK1
SCHEMBL5756318 0.81 ALDH1A1 (0.47) ELANENOTUMALDH1A1MAPT
SCHEMBL5758147 0.81 HPGD (0.47) ELANENOTUMPDE10AKLKB1KLK1

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 3 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
CN-1711243-A 2-pyridone derivatives as inhibitors of neutrophil elastase ASTRAZENECA AB (SE) 2005-12-21 CN 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 ELANE 2/4885NOTUM 3748/4885PDE10A 2816/4885

“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.