SCHEMBL2989018

SCHEMBL2989018

COc1cc2c(nc1OC)c(-c1cc3c(CCl)ccnc3n1S(=O)(=O)c1ccc(C)cc1)cn2C

nearest known ligand 0.34

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
PCSK9 Q8NBP7 3/20 0.34
PTGDR2 Q9Y5Y4 5/20 0.33
LMNA P02545 2/20 0.33
IGF1R P08069 1/20 0.33
TP53 P04637 2/20 0.32
PIM1 P11309 1/20 0.31
PIM2 Q9P1W9 1/20 0.31
MET P08581 1/20 0.31
AXL P30530 1/20 0.31
EED O75530 1/20 0.30
ALDH3A1 P30838 1/20 0.30
BRD4 O60885 1/20 0.30
HTR6 P50406 1/20 0.30
MAPT P10636 1/20 0.30
TSHR P16473 1/20 0.30
SMN1; SMN2 Q16637 1/20 0.30

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
SCHEMBL2991313 0.92 PCSK9 (0.34) PCSK9PTGDR2LMNAIGF1RTP53
SCHEMBL2995941 0.92 PTGDR2 (0.36) PCSK9PTGDR2LMNAIGF1RTP53
SCHEMBL3000511 0.90 LMNA (0.37) PCSK9PTGDR2LMNAIGF1RTP53
SCHEMBL2992419 0.89 PCSK9 (0.35) PCSK9PTGDR2IGF1REEDALDH3A1
SCHEMBL1748824 0.88 IGF1R (0.39) PCSK9PTGDR2IGF1RTP53MET
SCHEMBL2990418 0.87 MCHR1 (0.34) PCSK9PTGDR2IGF1RTP53PIM1
SCHEMBL2994855 0.87 PTGDR2 (0.36) PCSK9PTGDR2IGF1RTP53EED
SCHEMBL2990286 0.86 PTGDR2 (0.39) PCSK9PTGDR2LMNAIGF1RPIM1
SCHEMBL2996065 0.86 KDM4E (0.33) PCSK9PTGDR2LMNAIGF1RTP53
SCHEMBL2984632 0.85 PTGDR2 (0.34) PCSK9PTGDR2IGF1RPIM1PIM2

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-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-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-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
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 PCSK9 3685/4885PTGDR2 1281/4885LMNA 3052/4885
US-20100256141-A1 NOVEL BIS-AZAINDOLE DERIVATIVES, PREPARATION AND PHARMACEUTICAL USE THEREOF AS KINASE INHIBITORS BRSK2, KSR2, CDK2 PCSK9 3685/4885PTGDR2 1281/4885LMNA 3052/4885

“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.