SCHEMBL3263731

SCHEMBL3263731

CCCCCc1cnc2[nH]ccc2c1

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KDR P35968 2/20 0.61
▸ FGFR1 P11362 1/20 0.61
▸ CDK8 P49336 7/20 0.44
▸ AXL P30530 1/20 0.44
▸ PIK3CD O00329 1/20 0.43
▸ PIK3CA P42336 1/20 0.43
▸ PIK3CB P42338 1/20 0.43
▸ PIK3CG P48736 1/20 0.43
▸ RIPK1 Q13546 2/20 0.42
▸ ABL1 P00519 1/20 0.41
▸ GPR84 Q9NQS5 1/20 0.41
▸ BRD4 O60885 1/20 0.40
▸ FLT3 P36888 1/20 0.39
▸ NUDT1 P36639 1/20 0.39
▸ TDP1 Q9NUW8 1/20 0.39
▸ L3MBTL1 Q9Y468 1/20 0.39
▸ PLK4 O00444 1/20 0.39
▸ DCLK1 O15075 1/20 0.39
▸ ROCK2 O75116 1/20 0.39
▸ PRKD3 O94806 1/20 0.39

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
SCHEMBL19891723 0.95 KDR (0.62) KDRFGFR1CDK8AXLPIK3CD
SCHEMBL11990128 0.89 KDR (0.66) KDRFGFR1CDK8AXLPIK3CD
SCHEMBL18007157 0.83 RIPK1 (0.56) KDRFGFR1CDK8AXLPIK3CD
SCHEMBL29858603 0.82 KDR (0.60) KDRFGFR1CDK8AXLPIK3CD
SCHEMBL91324 0.82 KDR (0.60) KDRFGFR1CDK8AXLPIK3CD
SCHEMBL4562744 0.79 CDK8 (0.65) KDRFGFR1CDK8AXLPIK3CD
SCHEMBL1873717 0.78 KDR (0.53) KDRFGFR1CDK8AXLRIPK1
SCHEMBL1574435 0.78 PTGS2 (0.38) KDRFGFR1TDP1L3MBTL1
SCHEMBL298631 0.76 KDR (0.52) KDRFGFR1CDK8AXLRIPK1
SCHEMBL10283341 0.76 KDR (0.55) KDRFGFR1CDK8AXLPIK3CD

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-8470849-B2 7-azaindole derivatives as selective 11-β-hydroxysteroid dehydrogenase type 1 inhibitors MERCK PATENT GMBH (DE) 2013-06-25 — — US disclosed
EP-2247589-B1 7-AZAINDOLE DERIVATIVES AS SELECTIVE 11-BETA-HYDROXYSTEROID DEHYDROGENASE TYPE 1 INHIBITORS MERCK PATENT GMBH (DE) 2012-11-21 — — EP disclosed
EP-2247589-A1 7-AZAINDOLE DERIVATIVES AS SELECTIVE 11-BETA-HYDROXYSTEROID DEHYDROGENASE TYPE 1 INHIBITORS Merck Patent GmbH (DE) 2010-11-10 — — EP disclosed
US-20100267761-A1 7-Azaindole Derivatives as Selective 11-Beta-Hydroxysteroid Dehydrogenase Type 1 Inhibitors MERCK PATENT GESELLSCHAFT 2010-10-21 — — US disclosed
WO-2009059666-A1 7-AZAINDOLE DERIVATIVES AS SELECTIVE 11-BETA-HYDROXYSTEROID DEHYDROGENASE TYPE 1 INHIBITORS MERCK PATENT GMBH (DE) 2009-05-14 — — 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 (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-20100267761-A1 7-Azaindole Derivatives as Selective 11-Beta-Hydroxysteroid Dehydrogenase Type 1 Inhibitors HSD11B1, HSD17B1, HSD11B2 KDR 4126/4885FGFR1 4304/4885CDK8 3341/4885

“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.

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