SCHEMBL2877424

SCHEMBL2877424

Fc1ccc2nc(Cl)c3ccnc(Cl)c3c2c1

nearest known ligand 0.39

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
DHODH Q02127 2/20 0.39
BCHE P06276 5/20 0.37
ACHE P22303 5/20 0.37
GRIN1 Q05586 5/20 0.37
GRIN2A Q12879 5/20 0.37
CASP3 P42574 1/20 0.37
CCNC P24863 1/20 0.36
CDK8 P49336 1/20 0.36
PARP1 P09874 1/20 0.35
ALDH1A1 P00352 2/20 0.35
GAA P10253 1/20 0.35
HIPK2 Q9H2X6 1/20 0.35
KDM4E B2RXH2 1/20 0.34
MAPT P10636 1/20 0.34
MAPK1 P28482 1/20 0.34
MAP3K14 Q99558 1/20 0.34
SLC22A12 Q96S37 1/20 0.34
TYMS P04818 1/20 0.33
MPO P05164 1/20 0.33

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
SCHEMBL2463516 0.81 MAPT (0.37) DHODHCCNCCDK8ALDH1A1HIPK2
SCHEMBL2881698 0.81 HTT (0.45) DHODHBCHEACHEGRIN1GRIN2A
SCHEMBL2880111 0.73 JAK2 (0.36) DHODHALDH1A1HIPK2KDM4EMAPT
SCHEMBL29909019 0.72 BCHE (0.42) DHODHBCHEACHEGRIN1GRIN2A
SCHEMBL1991118 0.72 BCHE (0.42) DHODHBCHEACHEGRIN1GRIN2A
SCHEMBL1315422 0.72 MAPT (0.47) DHODHCCNCCDK8ALDH1A1HIPK2
SCHEMBL21870525 0.71 MAPT (0.61) DHODHCCNCCDK8ALDH1A1HIPK2
SCHEMBL2864926 0.69 JAK2 (0.43) ALDH1A1HIPK2KDM4EMAPTSLC22A12
SCHEMBL30738146 0.68 CYP3A4 (0.43) ALDH1A1HIPK2KDM4EMAPTMAPK1
SCHEMBL29691695 0.68 CCNC (0.49) CCNCCDK8PARP1ALDH1A1KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8349865-B2 Inhibitors of janus kinases MERCK SHARP & DOHME CORP. (US) 2013-01-08 US disclosed
US-8349865-B2 Inhibitors of janus kinases MERCK SHARP & DOHME CORP. (US) 2013-01-08 US disclosed
US-8349865-B2 Inhibitors of janus kinases MERCK SHARP & DOHME CORP. (US) 2013-01-08 US disclosed
EP-2200612-B1 INHIBITORS OF JANUS KINASES SCHERING CORP (US) 2012-08-08 EP disclosed
EP-2200612-B1 INHIBITORS OF JANUS KINASES SCHERING CORP (US) 2012-08-08 EP disclosed
US-20100197634-A1 INHIBITORS OF JANUS KINASES MERCK SHARP & DOHME LLC 2010-08-05 US disclosed
US-20100197634-A1 INHIBITORS OF JANUS KINASES MERCK SHARP & DOHME LLC 2010-08-05 US disclosed
US-20100197634-A1 INHIBITORS OF JANUS KINASES MERCK SHARP & DOHME LLC 2010-08-05 US disclosed
EP-2200612-A1 INHIBITORS OF JANUS KINASES Merck Sharp & Dohme Corp. (US) 2010-06-30 EP disclosed
WO-2009035575-A1 INHIBITORS OF JANUS KINASES MERCK & CO., INC. (US) 2009-03-19 WO disclosed
WO-2009035575-A1 INHIBITORS OF JANUS KINASES MERCK & CO., INC. (US) 2009-03-19 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-20100197634-A1 INHIBITORS OF JANUS KINASES JAK2, JAK3, JAK1 DHODH 2263/4885BCHE 4885/4885ACHE 4882/4885

“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.