SCHEMBL4580993

SCHEMBL4580993

O=C(O)c1ccc2cncc(Nc3cnccn3)c2n1

nearest known ligand 0.41

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 8/20 0.41
NAPRT Q6XQN6 1/20 0.41
HCAR2 Q8TDS4 1/20 0.41
MMP2 P08253 4/20 0.39
CCNC P24863 1/20 0.39
CDK8 P49336 1/20 0.39
KMT2A Q03164 4/20 0.36
MEN1 O00255 1/20 0.36
LMNA P02545 1/20 0.36
RAB9A P51151 4/20 0.35
NPC1 O15118 2/20 0.35
POLB P06746 1/20 0.34
MAPT P10636 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
SCHEMBL4579533 0.80 ADRA2A (0.47) KDM4EMMP2CCNCCDK8KMT2A
SCHEMBL4582757 0.79 GSK3A (0.42) KDM4EMMP2CCNCCDK8KMT2A
SCHEMBL4580845 0.78 MMP2 (0.46) KDM4EMMP2CCNCCDK8KMT2A
SCHEMBL4581196 0.77 ALDH1A1 (0.60) KDM4EKMT2AMEN1LMNARAB9A
SCHEMBL4580442 0.75 P4HTM (0.43) KDM4EMMP2CCNCCDK8KMT2A
SCHEMBL4581447 0.74 CCNC (0.39) KDM4EMMP2CCNCCDK8KMT2A
SCHEMBL4580475 0.72 AKR1C3 (0.48) KMT2AMEN1LMNARAB9ANPC1
SCHEMBL4581123 0.72 TAS2R14 (0.43) KDM4EMMP2CCNCCDK8RAB9A
SCHEMBL4579902 0.71 CCNC (0.43) KDM4EMMP2CCNCCDK8KMT2A
SCHEMBL4581101 0.71 KDM4C (0.49) KDM4EKMT2AMEN1POLB

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
US-20080032991-A1 2, 8-disubstituted Naphthyridine Derivatives SERENEX, INC. 2008-02-07 US claimed
US-7282506-B2 2,8-disubstituted naphthyridine derivatives SERENEX, INC. (US) 2007-10-16 US claimed
EP-1773834-A2 2, 8-DISUBSTITUTED NAPHTHYRIDINE DERIVATIVES Serenex, Inc. (US) 2007-04-18 EP claimed
WO-2006017672-A2 2, 8-DISUBSTITUTED NAPHTHYRIDINE DERIVATIVES SERENEX INC. (US) 2006-02-16 WO claimed
US-20060030584-A1 2,8-Disubstituted naphthyridine derivatives SERENEX, INC. 2006-02-09 US claimed

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-20060030584-A1 2,8-Disubstituted naphthyridine derivatives CCNA1, FOXM1, CCNA2 KDM4E 3744/4885NAPRT 1277/4885HCAR2 790/4885
US-20080032991-A1 2, 8-disubstituted Naphthyridine Derivatives CCNA1, FOXM1, CCNA2 KDM4E 3744/4885NAPRT 1277/4885HCAR2 790/4885

“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.