SCHEMBL2984459

SCHEMBL2984459

COc1cc2c(nc1OC)c(-c1cc3c(Cl)c(F)cnc3[nH]1)cn2CCCN1CCCN(C)CC1

nearest known ligand 0.36

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
KDR P35968 2/20 0.36
GSK3B P49841 2/20 0.36
SRC P12931 1/20 0.35
HRH4 Q9H3N8 3/20 0.35
CCNT1 O60563 8/20 0.33
CDK9 P50750 8/20 0.33
EGFR P00533 1/20 0.33
FGFR1 P11362 1/20 0.33
FLT1 P17948 1/20 0.33
FLT4 P35916 1/20 0.33
CSF1R P07333 2/20 0.32
TLR9 Q9NR96 1/20 0.32
TLR7 Q9NYK1 1/20 0.32
PGK1 P00558 1/20 0.32
QPCT Q16769 1/20 0.32

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
SCHEMBL2985854 0.97 KDR (0.37) KDRGSK3BSRCCCNT1CDK9
SCHEMBL2988529 0.94 GSK3B (0.36) KDRGSK3BCCNT1CDK9EGFR
SCHEMBL2982546 0.92 CDK9 (0.35) KDRCCNT1CDK9EGFRFGFR1
SCHEMBL2997352 0.89 CDK9 (0.40) KDRGSK3BSRCCCNT1CDK9
SCHEMBL2992455 0.88 CCNT1 (0.39) SRCCCNT1CDK9CSF1R
SCHEMBL2990280 0.87 HRH4 (0.39) KDRGSK3BSRCHRH4CCNT1
SCHEMBL2986599 0.87 HTR4 (0.34) CCNT1CDK9
SCHEMBL2988514 0.85 CDK9 (0.41) KDRGSK3BSRCCCNT1CDK9
SCHEMBL27714257 0.83 IGF1R (0.34) KDRGSK3BCCNT1CDK9FGFR1
SCHEMBL2990078 0.80 CDK9 (0.38) GSK3BCCNT1CDK9EGFRPGK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100256141-A1 NOVEL BIS-AZAINDOLE DERIVATIVES, PREPARATION AND PHARMACEUTICAL USE THEREOF AS KINASE INHIBITORS AVENTIS PHARMA S.A. (FR) 2010-10-07 US disclosed
US-7786114-B2 Bis-azaindole derivatives, preparation and pharmaceutical use thereof as kinase inhibitors AVENTIS PHARMA S.A. (FR) 2010-08-31 US disclosed
US-20080045561-A1 Novel Bis-Azaindole Derivatives, Preparation And Pharmaceutical Use Thereof As Kinase Inhibitors AVENTIS PHARMA S.A. (FR) 2008-02-21 US disclosed
EP-1799691-A1 NOVEL BIS-AZAINDOLE DERIVATIVES, PREPARATION AND PHARMACEUTICAL USE THEREOF AS KINASE INHIBITORS Aventis Pharma S.A. (FR) 2007-06-27 EP disclosed
WO-2006037875-A1 NOVEL BIS-AZAINDOLE DERIVATIVES, PREPARATION AND PHARMACEUTICAL USE THEREOF AS KINASE INHIBITORS AVENTIS PHARMA S.A. (FR) 2006-04-13 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 (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-20080045561-A1 Novel Bis-Azaindole Derivatives, Preparation And Pharmaceutical Use Thereof As Kinase Inhibitors BRSK2, KSR2, CDK2 KDR 637/4885GSK3B 438/4885SRC 229/4885
US-20100256141-A1 NOVEL BIS-AZAINDOLE DERIVATIVES, PREPARATION AND PHARMACEUTICAL USE THEREOF AS KINASE INHIBITORS BRSK2, KSR2, CDK2 KDR 637/4885GSK3B 438/4885SRC 229/4885

“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.