SCHEMBL13620036

SCHEMBL13620036

COc1ccc(Br)cc1Cn1c(=O)[nH]c2cnc(NCc3c[nH]cn3)nc21

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.39
KMT2A Q03164 2/20 0.39
RXFP1 Q9HBX9 1/20 0.39
MAPT P10636 3/20 0.39
MAPK1 P28482 2/20 0.39
KDM4E B2RXH2 2/20 0.39
GFER P55789 2/20 0.39
LMNA P02545 1/20 0.39
GAA P10253 1/20 0.39
MTOR P42345 1/20 0.36
CDK4 P11802 1/20 0.35
CCND1 P24385 1/20 0.35
CCND2 P30279 1/20 0.35
CCND3 P30281 1/20 0.35
TLR7 Q9NYK1 1/20 0.35
ALOX12 P18054 1/20 0.34
ALDH1A1 P00352 3/20 0.34
TDP1 Q9NUW8 1/20 0.34
USP2 O75604 1/20 0.34
CYP1A2 P05177 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
SCHEMBL13620043 0.90 IDH1 (0.38) MEN1KMT2AMAPTLMNAMTOR
SCHEMBL13608138 0.89 ADORA3 (0.36) MEN1KMT2ARXFP1ADORA3
SCHEMBL13620489 0.85 MAPT (0.41) MEN1KMT2ARXFP1MAPTMAPK1
SCHEMBL13620215 0.84 MEN1 (0.39) MEN1KMT2ARXFP1MAPTMAPK1
SCHEMBL13620263 0.82 JAK2 (0.40) MEN1KMT2ARXFP1MAPTMAPK1
SCHEMBL13620274 0.79 MEN1 (0.36) MEN1KMT2ARXFP1MAPTMAPK1
SCHEMBL13620183 0.78 MTOR (0.36) MEN1KMT2ARXFP1MAPTMAPK1
SCHEMBL13620197 0.78 DDR1 (0.41) MEN1KMT2ARXFP1ADORA3
SCHEMBL13620361 0.77 DDR1 (0.39) MEN1KMT2ARXFP1ADORA3
SCHEMBL13845184 0.77 DDR1 (0.45) MEN1KMT2AMAPK1LMNACDK4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090281075-A1 ISOMERIC PURINONES AND 1H-IMIDAZOPYRIDINONES AS PKC-THETA INHIBITORS PHARMACOPEIA, INC. (US) 2009-11-12 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-20090281075-A1 ISOMERIC PURINONES AND 1H-IMIDAZOPYRIDINONES AS PKC-THETA INHIBITORS PRKCE, PRKCZ, PRKCQ MEN1 3651/4885KMT2A 1404/4885RXFP1 3288/4885

“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.