SCHEMBL2488933

SCHEMBL2488933

Cc1nc2c3ccccc3cnc2c2ccccc12

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP2A6 P11509 3/20 0.44
CYP1A2 P05177 3/20 0.44
GPR3 P46089 2/20 0.44
KDM4E B2RXH2 2/20 0.44
CCR1 P32246 3/20 0.38
CCR8 P51685 3/20 0.38
L3MBTL1 Q9Y468 4/20 0.36
NPC1 O15118 2/20 0.36
CCR5 P51681 2/20 0.36
HSP90AA1 P07900 1/20 0.36
ALDH1A1 P00352 4/20 0.36
HPGD P15428 1/20 0.36
NUDT1 P36639 1/20 0.36
HSD17B10 Q99714 1/20 0.36
MAPT P10636 1/20 0.35
KMT2A Q03164 2/20 0.35
MEN1 O00255 1/20 0.35
RAB9A P51151 1/20 0.35
F12 P00748 1/20 0.34
PLAU P00749 1/20 0.34

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
SCHEMBL2488607 0.83 KDM4E (0.58) CYP2A6CYP1A2GPR3KDM4ECCR1
SCHEMBL24183817 0.79 CYP2A6 (0.42) CYP2A6CYP1A2GPR3KDM4ECCR1
SCHEMBL19748987 0.79 KDM4E (0.60) CYP2A6CYP1A2GPR3KDM4ECCR1
SCHEMBL2490181 0.77 KDM4E (0.44) CYP2A6CYP1A2GPR3KDM4ECCR1
SCHEMBL19007837 0.76 CCR1 (0.51) CYP2A6CYP1A2GPR3KDM4ECCR1
SCHEMBL24183837 0.76 CYP2A6 (0.55) CYP2A6CYP1A2GPR3KDM4ECCR1
SCHEMBL19007827 0.74 CYP2A6 (0.50) CYP2A6CYP1A2GPR3KDM4ENPC1
SCHEMBL18252753 0.74 GPR3 (0.52) CYP2A6CYP1A2GPR3KDM4EL3MBTL1
SCHEMBL10063498 0.74 CYP2A6 (0.43) CYP2A6CYP1A2GPR3KDM4ECCR1
SCHEMBL30779331 0.74 CYP2A6 (0.43) CYP2A6CYP1A2GPR3KDM4ECCR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1991546-B1 NOVEL DIBENZO[c,h][1,5]NAPHTHYRIDINES AND THEIR USE AS DNA PROBES INST CURIE (FR) 2011-10-26 EP disclosed
US-7728128-B2 Dibenzo[c,h][1,5]naphthyridines and their use as DNA probes INSTITUT NATIONAL DE LA SANTE ET DE LA RECHERCHE MEDICATE (INSERM) (FR) 2010-06-01 US disclosed
US-7728128-B2 Dibenzo[c,h][1,5]naphthyridines and their use as DNA probes INSTITUT NATIONAL DE LA SANTE ET DE LA RECHERCHE MEDICATE (INSERM) (FR) 2010-06-01 US disclosed
US-7728128-B2 Dibenzo[c,h][1,5]naphthyridines and their use as DNA probes INSTITUT NATIONAL DE LA SANTE ET DE LA RECHERCHE MEDICATE (INSERM) (FR) 2010-06-01 US disclosed
US-20090246772-A1 NOVEL DIBENZO[c,h][1,5]NAPHTHYRIDINES AND THEIR USE AS DNA PROBES INSTITUT CURIE (FR) 2009-10-01 US disclosed
US-20090246772-A1 NOVEL DIBENZO[c,h][1,5]NAPHTHYRIDINES AND THEIR USE AS DNA PROBES INSTITUT CURIE (FR) 2009-10-01 US disclosed
US-20090246772-A1 NOVEL DIBENZO[c,h][1,5]NAPHTHYRIDINES AND THEIR USE AS DNA PROBES INSTITUT CURIE (FR) 2009-10-01 US disclosed
EP-1991546-A1 NOVEL DIBENZO[c,h][1,5]NAPHTHYRIDINES AND THEIR USE AS DNA PROBES INSTITUT NATIONAL DE LA SANTE ET DE LA RECHERCHE MEDICALE (INSERM) (FR) 2008-11-19 EP disclosed
WO-2007096728-A1 NOVEL DIBENZO[c,h][1,5]NAPHTHYRIDINES AND THEIR USE AS DNA PROBES INSTITUT NATIONAL DE LA SANTÉ ET DE LA RECHERCHE MÉDICALE (INSERM) (FR) 2007-08-30 WO disclosed
EP-1826210-A1 Novel dibenzo[c,h][1,5]naphthyridines and their use as DNA probes INSTITUT NATIONAL DE LA SANTE ET DE LA RECHERCHE MEDICALE (INSERM) (FR) 2007-08-29 EP 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-20090246772-A1 NOVEL DIBENZO[c,h][1,5]NAPHTHYRIDINES AND THEIR USE AS DNA PROBES DNA2, DDB1, H1-5 CYP2A6 655/4885CYP1A2 398/4885GPR3 3651/4885

“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.