SCHEMBL254192

SCHEMBL254192

O=c1cc(Br)c2ccncc2n1CCN1CCOCC1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NFATC1 O95644 1/20 0.46
GSK3B P49841 1/20 0.46
DYRK1A Q13627 1/20 0.46
SMN1; SMN2 Q16637 2/20 0.41
NPC1 O15118 1/20 0.41
LMNA P02545 1/20 0.41
MAPT P10636 1/20 0.41
HTT P42858 1/20 0.41
RAB9A P51151 1/20 0.41
BLM P54132 1/20 0.41
ATM Q13315 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
ALOX15 P16050 1/20 0.40
MAPK1 P28482 1/20 0.40
GAA P10253 2/20 0.39
TSHR P16473 2/20 0.38
ALDH1A1 P00352 1/20 0.38
EGFR P00533 1/20 0.37
MAPK14 Q16539 1/20 0.37
POLB P06746 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
SCHEMBL14884437 0.80 NFATC1 (0.41) NFATC1GSK3BDYRK1ASMN1; SMN2NPC1
SCHEMBL4857617 0.77 NFATC1 (0.61) NFATC1GSK3BDYRK1ASMN1; SMN2NPC1
SCHEMBL26202615 0.71 DYRK1A (0.46) NFATC1GSK3BDYRK1ALMNA
SCHEMBL16099755 0.70 HASPIN (0.44) NFATC1GSK3BDYRK1ASMN1; SMN2LMNA
SCHEMBL16099658 0.70 NFATC1 (0.43) NFATC1GSK3BDYRK1ALMNAMAPT
SCHEMBL30365540 0.69 NFATC1 (0.46) NFATC1GSK3BDYRK1ASMN1; SMN2NPC1
SCHEMBL16099754 0.68 HASPIN (0.45) NFATC1GSK3BDYRK1ASMN1; SMN2NPC1
SCHEMBL21711353 0.68 NFATC1 (0.43) NFATC1GSK3BDYRK1ASMN1; SMN2NPC1
SCHEMBL247423 0.68 KIT (0.45) GAAPOLB
SCHEMBL16099686 0.68 NFATC1 (0.41) NFATC1GSK3BDYRK1ANPC1LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2585461-B1 2,4-DIARYL-SUBSTITUTED [1,8]NAPHTHYRIDINES AS KINASE INHIBITORS FOR USE AGAINST CANCER MERCK PATENT GMBH (DE) 2020-02-26 EP disclosed
EP-2585461-B1 2,4-DIARYL-SUBSTITUTED [1,8]NAPHTHYRIDINES AS KINASE INHIBITORS FOR USE AGAINST CANCER MERCK PATENT GMBH (DE) 2020-02-26 EP disclosed
US-8791113-B2 2,4-diaryl-substituted [1,8] naphthyridines as kinase inhibitors for use against cancer MERCK PATENT GMBH (DE) 2014-07-29 US disclosed
US-20130102603-A1 2,4-DIARYL - SUBSTITUTED [1,8] NAPHTHYRIDINES AS KINASE INHIBITORS FOR USE AGAINST CANCER MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 2013-04-25 US disclosed
WO-2012000595-A1 2,4- DIARYL - SUBSTITUTED [1,8] NAPHTHYRIDINES AS KINASE INHIBITORS FOR USE AGAINST CANCER MERCK PATENT GMBH (DE) 2012-01-05 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-20130102603-A1 2,4-DIARYL - SUBSTITUTED [1,8] NAPHTHYRIDINES AS KINASE INHIBITORS FOR USE AGAINST CANCER TGFBR1, TAB1, TGFBR2 NFATC1 860/4885GSK3B 164/4885DYRK1A 723/4885

“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.