SCHEMBL1748804

SCHEMBL1748804

COc1cc2c(-c3cc4c(CNc5ccccc5)ccnc4n3S(=O)(=O)c3ccc(C)cc3)cn(C)c2cc1OC

nearest known ligand 0.39

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
IGF1R P08069 1/20 0.39
PCSK9 Q8NBP7 3/20 0.37
PTGDR2 Q9Y5Y4 4/20 0.35
EED O75530 1/20 0.35
TP53 P04637 2/20 0.35
ELANE P08246 1/20 0.34
MAPT P10636 1/20 0.34
ALDH1A1 P00352 1/20 0.34
F2 P00734 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
TRIM24 O15164 1/20 0.34
TRIM33 Q9UPN9 1/20 0.34
ALOX15 P16050 1/20 0.34
ALOX12 P18054 1/20 0.34
SCN9A Q15858 1/20 0.34
HTR6 P50406 1/20 0.34

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
SCHEMBL1749211 0.90 IGF1R (0.39) IGF1RPCSK9PTGDR2EEDTP53
SCHEMBL1749204 0.88 L3MBTL1 (0.40) IGF1REEDTP53MAPTALDH1A1
SCHEMBL1750570 0.88 IGF1R (0.34) IGF1RPCSK9PTGDR2EEDTP53
SCHEMBL1748721 0.88 IGF1R (0.37) IGF1RPCSK9PTGDR2TRIM24TRIM33
SCHEMBL1749482 0.88 KMT2A (0.42) TP53MAPTALDH1A1ALOX12
SCHEMBL5793402 0.88 IGF1R (0.36) IGF1RPCSK9PTGDR2EEDTP53
SCHEMBL1749187 0.87 BCHE (0.36) IGF1RPCSK9PTGDR2TRIM24TRIM33
SCHEMBL1749257 0.86 IGF1R (0.39) IGF1RPCSK9PTGDR2EEDTP53
SCHEMBL1748824 0.86 IGF1R (0.39) IGF1RPCSK9PTGDR2EEDTP53
SCHEMBL1749798 0.86 PTGDR2 (0.39) IGF1RPCSK9PTGDR2TP53SCN9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7528147-B2 Pyrrolo (2,3-b)pyridine derivatives, the preparation and the pharmaceutical use thereof in the form of kinase inhibitors AVENTIS PHARMA S.A. (FR) 2009-05-05 US disclosed
US-20070093480-A1 Novel pyrrolo (2,3-b)pyridine derivatives, the preparation and the pharmaceutical use thereof in the form of kinase inhibitors AVENTIS PHARMA S.A. (FR) 2007-04-26 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 (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-20070093480-A1 Novel pyrrolo (2,3-b)pyridine derivatives, the preparation and the pharmaceutical use thereof in the form of kinase inhibitors MAP3K19, MAP4K2, MAP3K1 IGF1R 817/4885PCSK9 3328/4885PTGDR2 806/4885

“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.