SCHEMBL3010067

SCHEMBL3010067

CCCOc1ccc(Nc2c(C)c(N[C@H]3CC[C@H](N)CC3)nn3ccnc23)cc1

nearest known ligand 0.49

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
MAPKAPK2 P49137 8/20 0.49
CDK2 P24941 6/20 0.42
CCNE1 P24864 5/20 0.42
FLT3 P36888 2/20 0.42
MAPK8 P45983 1/20 0.38
SYK P43405 1/20 0.37
CDK1 P06493 1/20 0.37
PDGFRA P16234 5/20 0.37
BTK Q06187 1/20 0.35
MAPT P10636 1/20 0.35

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
SCHEMBL13213485 0.92 MAPKAPK2 (0.58) MAPKAPK2CDK2CCNE1FLT3MAPK8
SCHEMBL13213670 0.92 MAPKAPK2 (0.58) MAPKAPK2CDK2CCNE1FLT3MAPK8
SCHEMBL3015203 0.86 MAPKAPK2 (0.47) MAPKAPK2CDK2CCNE1FLT3MAPK8
SCHEMBL13213948 0.84 FLT3 (0.44) MAPKAPK2CDK2CCNE1FLT3MAPK8
SCHEMBL3024265 0.84 MAPK8 (0.48) MAPKAPK2CDK2CCNE1FLT3MAPK8
SCHEMBL13213636 0.84 MAPKAPK2 (0.52) MAPKAPK2CDK2CCNE1FLT3MAPK8
SCHEMBL3022411 0.83 CDK2 (0.43) MAPKAPK2CDK2CCNE1FLT3MAPK8
SCHEMBL3011533 0.83 MAPKAPK2 (0.51) MAPKAPK2CDK2CCNE1FLT3MAPK8
SCHEMBL3022446 0.81 MAPKAPK2 (0.36) MAPKAPK2CDK2CCNE1FLT3SYK
SCHEMBL3022048 0.81 FLT3 (0.45) MAPKAPK2CDK2CCNE1FLT3MAPK8

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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
US-20080045536-A1 FUSED HETEROCYCLIC COMPOUNDS USEFUL AS KINASE MODULATORS BRISTOL-MYERS SQUIBB COMPANY 2008-02-21 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 (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-20100204212-A1 FUSED HETEROCYCLIC COMPOUNDS USEFUL AS KINASE MODULATORS MAP2K2, MAP3K2, MAP4K2 MAPKAPK2 23/4885CDK2 40/4885CCNE1 468/4885
US-20080045536-A1 FUSED HETEROCYCLIC COMPOUNDS USEFUL AS KINASE MODULATORS MAP3K3, MAP3K2, MAP4K3 MAPKAPK2 24/4885CDK2 67/4885CCNE1 538/4885

“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.