SCHEMBL2994829

SCHEMBL2994829

COc1cc2c(nc1OC)c(-c1cc3c(CNC(COC(=O)C(F)(F)F)c4ccccc4)ccnc3[nH]1)cn2C

nearest known ligand 0.37

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
IGF1R P08069 1/20 0.37
EGFR P00533 12/20 0.36
CCNT1 O60563 6/20 0.35
CDK9 P50750 6/20 0.35
CHUK O15111 1/20 0.33
INSR P06213 1/20 0.33
MAPK8 P45983 1/20 0.33
CAMKK2 Q96RR4 1/20 0.33

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
Trifluoroacetic Acid SCHEMBL2994826 0.91 EGFR (0.42) IGF1REGFRCCNT1CDK9CHUK
SCHEMBL5531384 0.87 EGFR (0.46) IGF1REGFRCCNT1CDK9CHUK
SCHEMBL2991608 0.85 IGF1R (0.37) IGF1REGFRCCNT1CDK9CHUK
Trifluoroacetic Acid SCHEMBL2991605 0.84 IGF1R (0.38) IGF1REGFRCCNT1CDK9CHUK
SCHEMBL2984504 0.81 IGF1R (0.39) IGF1RCCNT1CDK9CHUKINSR
SCHEMBL2984469 0.81 IGF1R (0.39) IGF1RCCNT1CDK9CHUKINSR
Trifluoroacetic Acid SCHEMBL2984463 0.81 IGF1R (0.40) IGF1RCCNT1CDK9
Trifluoroacetic Acid SCHEMBL2984502 0.81 IGF1R (0.40) IGF1RCCNT1CDK9CHUKINSR
SCHEMBL5531129 0.80 IGF1R (0.42) IGF1REGFR
SCHEMBL5531332 0.79 IGF1R (0.42) IGF1RCCNT1CDK9CHUKINSR

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-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

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 IGF1R 606/4885EGFR 560/4885CCNT1 327/4885
US-20100256141-A1 NOVEL BIS-AZAINDOLE DERIVATIVES, PREPARATION AND PHARMACEUTICAL USE THEREOF AS KINASE INHIBITORS BRSK2, KSR2, CDK2 IGF1R 606/4885EGFR 560/4885CCNT1 327/4885

“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.