SCHEMBL2984674

SCHEMBL2984674

COc1cc2[nH]cc(-c3cc4c(Cl)c(F)cnc4[nH]3)c2nc1OC

nearest known ligand 0.39

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
EGFR P00533 3/20 0.39
DAO P14920 1/20 0.38
DDO Q99489 1/20 0.38
CCNT1 O60563 9/20 0.35
CDK9 P50750 9/20 0.35
ORAI1 Q96D31 1/20 0.34
KIT P10721 3/20 0.33
MAP3K11 Q16584 2/20 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
SCHEMBL2990264 0.82 EGFR (0.38) EGFRCCNT1CDK9
SCHEMBL27714257 0.78 IGF1R (0.34) DAODDOCCNT1CDK9ORAI1
SCHEMBL2993667 0.76 TBK1 (0.41) CCNT1CDK9
SCHEMBL2982546 0.73 CDK9 (0.35) EGFRCCNT1CDK9
SCHEMBL2988514 0.72 CDK9 (0.41) EGFRCCNT1CDK9
SCHEMBL9987778 0.71 TBK1 (0.36) CCNT1CDK9KIT
SCHEMBL2997352 0.70 CDK9 (0.40) EGFRCCNT1CDK9KIT
SCHEMBL2996261 0.70 PIM1 (0.34) EGFR
SCHEMBL2984459 0.69 KDR (0.36) EGFRCCNT1CDK9
SCHEMBL31554465 0.66 ALDH1A1 (0.41) EGFR

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 EGFR 560/4885DAO 2687/4885DDO 3273/4885
US-20100256141-A1 NOVEL BIS-AZAINDOLE DERIVATIVES, PREPARATION AND PHARMACEUTICAL USE THEREOF AS KINASE INHIBITORS BRSK2, KSR2, CDK2 EGFR 560/4885DAO 2687/4885DDO 3273/4885

“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.