SCHEMBL8203003

SCHEMBL8203003

O=c1oc(-c2ccccn2)nc2ccccc12

nearest known ligand 0.63

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ELANE P08246 6/20 0.63
ALDH1A1 P00352 5/20 0.63
NPC1 O15118 4/20 0.63
RAB9A P51151 4/20 0.63
KDM4E B2RXH2 3/20 0.63
HPGD P15428 3/20 0.63
SMN1; SMN2 Q16637 3/20 0.63
TP53 P04637 1/20 0.63
CYP1A2 P05177 1/20 0.63
CYP2C9 P11712 1/20 0.63
CYP2C19 P33261 1/20 0.63
HSD17B10 Q99714 1/20 0.63
F2 P00734 3/20 0.56
C1R P00736 6/20 0.55
L3MBTL1 Q9Y468 2/20 0.55
KMT2A Q03164 2/20 0.55
NPSR1 Q6W5P4 1/20 0.55
LMNA P02545 1/20 0.55
GAA P10253 1/20 0.55
HTT P42858 1/20 0.55

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
SCHEMBL12352106 0.85 ELANE (0.69) ELANEALDH1A1NPC1RAB9AKDM4E
SCHEMBL12352121 0.83 ELANE (0.67) ELANEALDH1A1NPC1RAB9AKDM4E
SCHEMBL13700923 0.83 ELANE (0.67) ELANEALDH1A1NPC1RAB9AKDM4E
SCHEMBL13700917 0.83 F2 (0.63) ELANEALDH1A1NPC1RAB9AKDM4E
SCHEMBL13701235 0.83 KDM4E (0.50) ELANEALDH1A1NPC1RAB9AKDM4E
SCHEMBL13700978 0.83 NPC1 (0.63) ELANEALDH1A1NPC1RAB9AKDM4E
SCHEMBL272287 0.82 ELANE (0.81) ELANEALDH1A1NPC1RAB9AKDM4E
SCHEMBL12352119 0.81 ELANE (0.59) ELANEALDH1A1NPC1RAB9AKDM4E
SCHEMBL13700921 0.81 ELANE (0.59) ELANEALDH1A1NPC1RAB9AKDM4E
SCHEMBL12352108 0.80 ELANE (0.67) ELANEALDH1A1NPC1RAB9AKDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7879846-B2 e.g. 2-(2-Imidazol-1-yl-pyridin-3-yl)-5-methyl-4H-benz[d][1,3]oxazin-4-one ; neutrophil elastase inhibitor; antiinflammatory agent, respiratory system disorders Kyorin Pharmaceutical Co.., Ltd. (JP) 2011-02-01 US disclosed
US-7879846-B2 e.g. 2-(2-Imidazol-1-yl-pyridin-3-yl)-5-methyl-4H-benz[d][1,3]oxazin-4-one ; neutrophil elastase inhibitor; antiinflammatory agent, respiratory system disorders Kyorin Pharmaceutical Co.., Ltd. (JP) 2011-02-01 US disclosed
US-20090239982-A1 Ultraviolet Absorbent and Heterocyclic Compound FUJIFILM CORPORATION (JP) 2009-09-24 US disclosed
US-20090239982-A1 Ultraviolet Absorbent and Heterocyclic Compound FUJIFILM CORPORATION (JP) 2009-09-24 US disclosed
US-20080161290-A1 Serine hydrolase inhibitors KYORIN PHARMACEUTICAL CO., LTD. (JP) 2008-07-03 US disclosed
US-20080161290-A1 Serine hydrolase inhibitors KYORIN PHARMACEUTICAL CO., LTD. (JP) 2008-07-03 US disclosed
WO-2008036379-A2 SERINE HYDROLASE INHIBITORS ACTIVX BIOSCIENCES, INC. (US) 2008-03-27 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 (2 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-20080161290-A1 Serine hydrolase inhibitors SERPINB1, ELANE, EPX ELANE 2/4885ALDH1A1 981/4885NPC1 1286/4885
US-20090239982-A1 Ultraviolet Absorbent and Heterocyclic Compound CYP2A6, CYP2B6, XPO6 ELANE 1479/4885ALDH1A1 1360/4885NPC1 1604/4885

“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.