SCHEMBL9959092

SCHEMBL9959092

CC(N)c1cc2cccnc2nc1-c1ccccc1

nearest known ligand 0.44

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
DHODH Q02127 1/20 0.40
PIK3CG P48736 1/20 0.37
NPC1 O15118 1/20 0.36
ADORA2A P29274 3/20 0.35
MET P08581 1/20 0.35
BACE1 P56817 1/20 0.35
MAPK14 Q16539 2/20 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
SCHEMBL9223901 0.88 DHODH (0.42) DHODHPIK3CGNPC1METBACE1
SCHEMBL20061458 0.78 PDE10A (0.57) PIK3CGNPC1
SCHEMBL20061318 0.78 PDE10A (0.57) PIK3CGNPC1
SCHEMBL8669576 0.77 ADORA2A (0.38) DHODHPIK3CGADORA2A
SCHEMBL28261532 0.76 PDE10A (0.59) DHODHNPC1BACE1
SCHEMBL6004191 0.76 DHODH (0.41) DHODHPIK3CGNPC1ADORA2A
SCHEMBL10080210 0.75 PIK3CG (0.37) DHODHPIK3CGADORA2AMETMAPK14
SCHEMBL15302654 0.75 PIK3CG (0.37) DHODHPIK3CGADORA2AMETMAPK14
SCHEMBL9953062 0.75 PIK3CG (0.37) DHODHPIK3CGADORA2AMETMAPK14
SCHEMBL361776 0.74 AKT1 (0.49) DHODHNPC1ADORA2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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 2700/4885PIK3CG 59/4885NPC1 4540/4885

“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.