SCHEMBL3017152

SCHEMBL3017152

CCOc1ccc(Nc2cc(Cl)nn3c(C)cnc23)cc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EHMT2 Q96KQ7 1/20 0.46
MAPT P10636 6/20 0.45
MAPK1 P28482 2/20 0.45
TP53 P04637 2/20 0.44
POLB P06746 1/20 0.44
KDM4E B2RXH2 1/20 0.44
NFKB1 P19838 1/20 0.44
TSHR P16473 2/20 0.43
ALOX15 P16050 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
NPSR1 Q6W5P4 1/20 0.43
NR3C1 P04150 1/20 0.41
RAB9A P51151 3/20 0.39
NPC1 O15118 1/20 0.39
JAK2 O60674 1/20 0.39
HTT P42858 1/20 0.39
SLC2A1 P11166 1/20 0.38
PDGFRB P09619 1/20 0.38
FGFR1 P11362 1/20 0.38
SRC P12931 1/20 0.38

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
SCHEMBL3026977 0.87 KDM4E (0.43) EHMT2MAPTMAPK1TP53POLB
SCHEMBL3019176 0.87 KDM4E (0.43) EHMT2MAPTMAPK1TP53POLB
SCHEMBL3018033 0.84 KDM4E (0.42) EHMT2MAPTMAPK1TP53POLB
SCHEMBL3013186 0.82 EHMT2 (0.47) EHMT2MAPTMAPK1TP53POLB
SCHEMBL3017950 0.77 KDM4E (0.45) EHMT2MAPTMAPK1TP53POLB
SCHEMBL13213852 0.76 CCNE1 (0.66)
SCHEMBL17922269 0.74 AKT1 (0.39) MAPTKDM4EAKT1
SCHEMBL24263560 0.73 TYK2 (0.38)
SCHEMBL14699730 0.70 KDM4E (0.42) EHMT2MAPTMAPK1KDM4ENFKB1
SCHEMBL14547384 0.68 MAPT (0.46) EHMT2MAPTMAPK1TP53POLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1928879-B1 FUSED HETEROCYCLIC COMPOUNDS USEFUL AS KINASE MODULATORS BRISTOL MYERS SQUIBB CO (US) 2013-02-13 EP disclosed
US-20100204212-A1 FUSED HETEROCYCLIC COMPOUNDS USEFUL AS KINASE MODULATORS BRISTOL-MYERS SQUIBB COMPANY 2010-08-12 US disclosed
US-7723336-B2 Fused heterocyclic compounds useful as kinase modulators BRISTOL-MYERS SQUIBB COMPANY (US) 2010-05-25 US disclosed
EP-1928879-A2 FUSED HETEROCYCLIC COMPOUNDS USEFUL AS KINASE MODULATORS Brystol-Myers Squibb Company (US) 2008-06-11 EP disclosed
US-20080045536-A1 FUSED HETEROCYCLIC COMPOUNDS USEFUL AS KINASE MODULATORS BRISTOL-MYERS SQUIBB COMPANY 2008-02-21 US disclosed
WO-2007038314-A2 FUSED HETEROCYCLIC COMPOUNDS USEFUL AS KINASE MODULATORS BRISTOL-MYERS SQUIBB COMPANY (US) 2007-04-05 WO disclosed
US-20070078136-A1 Fused heterocyclic compounds useful as kinase modulators BRISTOL-MYERS SQUIBB COMPANY 2007-04-05 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 (3 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-20070078136-A1 Fused heterocyclic compounds useful as kinase modulators MAP3K2, MAP3K3, MAP4K2 EHMT2 1058/4885MAPT 3377/4885MAPK1 45/4885
US-20100204212-A1 FUSED HETEROCYCLIC COMPOUNDS USEFUL AS KINASE MODULATORS MAP2K2, MAP3K2, MAP4K2 EHMT2 989/4885MAPT 3471/4885MAPK1 64/4885
US-20080045536-A1 FUSED HETEROCYCLIC COMPOUNDS USEFUL AS KINASE MODULATORS MAP3K3, MAP3K2, MAP4K3 EHMT2 1302/4885MAPT 3886/4885MAPK1 68/4885

“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.