SCHEMBL9953697

SCHEMBL9953697

CCc1cc2cccnc2nc1-c1ccccc1

nearest known ligand 0.46

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
DHODH Q02127 2/20 0.45
SLC40A1 Q9NP59 1/20 0.41
KDM4E B2RXH2 2/20 0.38
MEN1 O00255 2/20 0.38
KMT2A Q03164 2/20 0.38
LMNA P02545 1/20 0.38
HCRTR1 O43613 1/20 0.38
HCRTR2 O43614 1/20 0.38
NPC1 O15118 1/20 0.37
AKT1 P31749 2/20 0.37
AKT2 P31751 2/20 0.37
SUCNR1 Q9BXA5 1/20 0.37
ALDH1A1 P00352 2/20 0.37
MAPT P10636 2/20 0.37
PDE4A P27815 1/20 0.36

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
SCHEMBL30724619 1.00 DHODH (0.45) DHODHSLC40A1KDM4EMEN1KMT2A
SCHEMBL9068281 0.88 DHODH (0.40) DHODHKDM4ENPC1AKT1AKT2
SCHEMBL28261532 0.79 PDE10A (0.59) DHODHKDM4EMEN1KMT2ALMNA
SCHEMBL28083059 0.78 TDP1 (0.45) KDM4EMEN1KMT2ALMNANPC1
SCHEMBL12895010 0.77 ALDH1A1 (0.40) SLC40A1KDM4EMEN1KMT2ALMNA
SCHEMBL12134726 0.77 PSMB5 (0.41) SLC40A1KDM4EMEN1KMT2ALMNA
SCHEMBL361776 0.77 AKT1 (0.49) DHODHMEN1KMT2ALMNANPC1
SCHEMBL20081370 0.77 PDE10A (0.61) KDM4EMEN1KMT2ALMNANPC1
SCHEMBL9958654 0.76 DHODH (0.49) DHODHKDM4EMEN1KMT2ALMNA
SCHEMBL1692394 0.76 DHODH (0.44) DHODHKDM4EMEN1KMT2ALMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-112778306-B Synthesis method of 1, 8-naphthyridine derivative 吉林化工学院 2024-01-26 CN disclosed
CN-112778306-A Synthetic method of 1, 8-naphthyridine derivative 吉林化工学院 2021-05-11 CN disclosed
EP-2655342-A1 HETEROCYCLIC COMPOUNDS AND THEIR USES Amgen Inc. (US) 2013-10-30 EP disclosed
US-20130267526-A1 HETEROCYCLIC COMPOUNDS AND THEIR USES AMGEN, INC. (CA) 2013-10-10 US disclosed
US-20130267526-A1 HETEROCYCLIC COMPOUNDS AND THEIR USES AMGEN, INC. (CA) 2013-10-10 US disclosed
US-20130267526-A1 HETEROCYCLIC COMPOUNDS AND THEIR USES AMGEN, INC. (CA) 2013-10-10 US disclosed
WO-2012087784-A1 HETEROCYCLIC COMPOUNDS AND THEIR USES AMGEN INC. (US) 2012-06-28 WO disclosed
WO-2012087784-A1 HETEROCYCLIC COMPOUNDS AND THEIR USES AMGEN INC. (US) 2012-06-28 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-20130267526-A1 HETEROCYCLIC COMPOUNDS AND THEIR USES MCL1, BCL9, MALT1 DHODH 2700/4885SLC40A1 4324/4885KDM4E 1545/4885

“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.