SCHEMBL5494272

SCHEMBL5494272

Nc1ccc(-c2ccc3nc(N)ncc3c2)cc1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ LCK P06239 10/20 0.58
▸ KDR P35968 4/20 0.58
▸ JAK3 P52333 1/20 0.58
▸ MAPK14 Q16539 1/20 0.58
▸ DHFR P00374 1/20 0.50
▸ PRKCZ Q05513 1/20 0.47
▸ KIT P10721 7/20 0.45
▸ SRC P12931 7/20 0.45
▸ CSNK1D P48730 1/20 0.45
▸ CSNK1E P49674 1/20 0.45
▸ CLK1 P49759 1/20 0.45
▸ DYRK1A Q13627 1/20 0.45
▸ BACE1 P56817 2/20 0.43
▸ KDM4E B2RXH2 1/20 0.42
▸ MEN1 O00255 1/20 0.42
▸ NPC1 O15118 1/20 0.42
▸ ALDH1A1 P00352 1/20 0.42
▸ TP53 P04637 1/20 0.42
▸ MAPT P10636 1/20 0.42
▸ HPGD P15428 1/20 0.42

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
SCHEMBL2741576 0.87 LCK (0.65) LCKKDRJAK3MAPK14DHFR
SCHEMBL3025007 0.86 LCK (0.55) LCKKDRJAK3MAPK14DHFR
SCHEMBL12575879 0.86 LCK (0.55) LCKKDRJAK3MAPK14KIT
SCHEMBL28084462 0.85 DHFR (0.54) LCKKDRJAK3MAPK14DHFR
SCHEMBL5488838 0.84 MAP4K4 (0.61) LCKKDRJAK3MAPK14KIT
SCHEMBL30912753 0.84 EGFR (0.57) LCKKDRJAK3MAPK14KIT
SCHEMBL610225 0.84 EGFR (0.57) LCKKDRJAK3MAPK14KIT
Benzene SCHEMBL28800797 0.81 EGFR (0.53) LCKKDRJAK3MAPK14KIT
SCHEMBL5489139 0.79 LCK (0.72) LCKKDRJAK3MAPK14DHFR
SCHEMBL5492816 0.79 LCK (0.72) LCKKDRJAK3MAPK14DHFR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1836174-B2 ARYL NITROGEN-CONTAINING BICYCLIC COMPOUNDS AND THEIR USE AS KINASE INHIBITORS AMGEN INC (US) 2019-10-02 — — EP disclosed
EP-1836174-B1 ARYL NITROGEN-CONTAINING BICYCLIC COMPOUNDS AND THEIR USE AS KINASE INHIBITORS AMGEN INC (US) 2013-02-27 — — EP disclosed
EP-1836174-A2 ARYL NITROGEN-CONTAINING BICYCLIC COMPOUNDS AND THEIR USE AS KINASE INHIBITORS AMGEN INC. (US) 2007-09-26 — — EP disclosed
US-20070054916-A1 Aryl nitrogen-containing bicyclic compounds and methods of use AMGEN INC. 2007-03-08 — — US disclosed
US-20070054916-A1 Aryl nitrogen-containing bicyclic compounds and methods of use AMGEN INC. 2007-03-08 — — US disclosed
US-20070054916-A1 Aryl nitrogen-containing bicyclic compounds and methods of use AMGEN INC. 2007-03-08 — — US disclosed
WO-2006039718-A2 ARYL NITROGEN-CONTAINING BICYCLIC COMPOUNDS AND THEIR USE AS KINASE INHIBITORS AMGEN INC (US) 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 (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-20070054916-A1 Aryl nitrogen-containing bicyclic compounds and methods of use MAP3K1, MAP3K5, MAP3K2 LCK 106/4885KDR 1044/4885JAK3 60/4885

“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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