SCHEMBL4723196

SCHEMBL4723196

CNCc1cc(Br)cnc1Cl

nearest known ligand 0.41

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
SLC6A4 P31645 13/20 0.40
HTR2A P28223 2/20 0.40
KCNH2 Q12809 2/20 0.40
SLC6A2 P23975 10/20 0.40
SLC6A3 Q01959 3/20 0.36
MEN1 O00255 2/20 0.34
MAPT P10636 2/20 0.34
HPGD P15428 2/20 0.34
KMT2A Q03164 2/20 0.34
PKM P14618 1/20 0.34
HTT P42858 1/20 0.34
HRH3 Q9Y5N1 1/20 0.34
GFER P55789 1/20 0.33
HIF1A Q16665 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
SCHEMBL2847704 0.81 KMT2A (0.38) SLC6A4HTR2AKCNH2SLC6A2SLC6A3
SCHEMBL25233643 0.79 ALDH1A1 (0.39) MAPTKMT2AHTT
SCHEMBL18497250 0.78 SETDB1 (0.47) MAPT
SCHEMBL18588980 0.78 SLC6A4 (0.42) SLC6A4HTR2AKCNH2SLC6A2SLC6A3
SCHEMBL1093855 0.78 KMT2A (0.48) SLC6A4HTR2AKCNH2SLC6A2MEN1
SCHEMBL31430877 0.76 KMT2A (0.37) MEN1MAPTHPGDKMT2APKM
SCHEMBL856508 0.76 KMT2A (0.37) MEN1MAPTHPGDKMT2APKM
SCHEMBL5046239 0.76 KMT2A (0.35) MEN1MAPTHPGDKMT2APKM
SCHEMBL1543624 0.75 PDXK (0.46) MEN1MAPTHPGDKMT2APKM
SCHEMBL15052847 0.75 HTT (0.34) MEN1MAPTHPGDKMT2APKM

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1899334-B1 NAPHTHYRIDINE COMPOUNDS JANSSEN PHARMACEUTICA NV (BE) 2008-09-24 EP disclosed
EP-1899334-B1 NAPHTHYRIDINE COMPOUNDS JANSSEN PHARMACEUTICA NV (BE) 2008-09-24 EP disclosed
US-7417054-B2 Naphthyridine compounds JANSSEN PHARMACEUTICA N.V. (BG) 2008-08-26 US disclosed
US-7417054-B2 Naphthyridine compounds JANSSEN PHARMACEUTICA N.V. (BG) 2008-08-26 US disclosed
US-7417054-B2 Naphthyridine compounds JANSSEN PHARMACEUTICA N.V. (BG) 2008-08-26 US disclosed
CN-101243083-A Naphthyridine compounds JANSSEN PHARMACEUTICA NV (BE) 2008-08-13 CN disclosed
EP-1899334-A2 NAPHTHYRIDINE COMPOUNDS JANSSEN PHARMACEUTICA N.V. (BE) 2008-03-19 EP disclosed
WO-2006138714-A2 NAPHTHYRIDINE COMPOUNDS JANSSEN PHARMACEUTICA N.V. (BE) 2006-12-28 WO disclosed
US-20060287292-A1 NAPHTHYRIDINE COMPOUNDS JANSSEN PHARMACEUTICA N.V. (BE) 2006-12-21 US 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-20060287292-A1 NAPHTHYRIDINE COMPOUNDS HRH3, HRH4, HRH1 SLC6A4 10/4885HTR2A 13/4885KCNH2 2031/4885

“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.