SCHEMBL3584350

SCHEMBL3584350

Cc1cc(Nc2cc(N)ccc2C)n(-c2cc(Nc3ccc(CN4CCOCC4)cn3)ncn2)n1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LCK P06239 2/20 0.41
KDR P35968 2/20 0.41
INSR P06213 1/20 0.41
LYN P07948 1/20 0.41
SRC P12931 1/20 0.41
IKBKE Q14164 2/20 0.39
TBK1 Q9UHD2 2/20 0.39
CDK1 P06493 1/20 0.37
CDK4 P11802 1/20 0.37
CDK6 Q00534 1/20 0.37
CCNE1 P24864 1/20 0.37
CDK2 P24941 1/20 0.37
HSF1 Q00613 1/20 0.37
MAPK10 P53779 2/20 0.37
ALDH1A1 P00352 1/20 0.37
PDGFRB P09619 1/20 0.37
AURKA O14965 1/20 0.36
RPS6KB1 P23443 1/20 0.36
ADORA2A P29274 2/20 0.36
SLC34A1 Q06495 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
SCHEMBL3584346 0.88 AURKA (0.42) LCKKDRINSRLYNSRC
SCHEMBL3588778 0.83 MAPK14 (0.41) LCKKDRINSRLYNSRC
SCHEMBL3579680 0.82 CYP1A2 (0.51) LCKALDH1A1LMNA
SCHEMBL3596858 0.82 MAPK14 (0.45)
SCHEMBL9970945 0.82 FLT3 (0.42) IKBKETBK1ADORA2ACNR2
SCHEMBL3590168 0.80 BRAF (0.36) LCKKDRMAPK10ALDH1A1PDGFRB
SCHEMBL9967438 0.80 FLT3 (0.44) CDK2
SCHEMBL3587592 0.79 BRAF (0.46) LCKKDRINSRLYNSRC
SCHEMBL3583322 0.76 MAPT (0.51) MAPK10ALDH1A1SLC34A1LMNA
SCHEMBL3579677 0.71 CYP1A2 (0.47) LCKKDRINSRLYNSRC

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
US-8202876-B2 Compounds and compositions as protein kinase inhibitors IRM LLC (BM) 2012-06-19 US claimed
US-20100029605-A1 COMPOUNDS AND COMPOSITIONS AS PROTEIN KINASE INHIBITORS IRM LLC (BM) 2010-02-04 US claimed
EP-2057146-A1 COMPOUNDS AND COMPOSITIONS AS PROTEIN KINASE INHIBITORS IRM LLC (BM) 2009-05-13 EP claimed
WO-2008042639-A1 COMPOUNDS AND COMPOSITIONS AS PROTEIN KINASE INHIBITORS IRM LLC (BM) 2008-04-10 WO claimed
US-8202876-B2 Compounds and compositions as protein kinase inhibitors IRM LLC (BM) 2012-06-19 US disclosed
US-20100029605-A1 COMPOUNDS AND COMPOSITIONS AS PROTEIN KINASE INHIBITORS IRM LLC (BM) 2010-02-04 US disclosed
EP-2057146-A1 COMPOUNDS AND COMPOSITIONS AS PROTEIN KINASE INHIBITORS IRM LLC (BM) 2009-05-13 EP disclosed
WO-2008042639-A1 COMPOUNDS AND COMPOSITIONS AS PROTEIN KINASE INHIBITORS IRM LLC (BM) 2008-04-10 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-20100029605-A1 COMPOUNDS AND COMPOSITIONS AS PROTEIN KINASE INHIBITORS FYN, ABL2, LCK LCK 3/4885KDR 13/4885INSR 931/4885

“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.