SCHEMBL10476364

SCHEMBL10476364

COc1cc(OC)c(OC)cc1C=C(C#N)c1nc2ccccc2[nH]1

nearest known ligand 0.82

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 11/20 0.82
▸ CDC7 O00311 1/20 0.74
▸ PLK4 O00444 1/20 0.74
▸ CHEK1 O14757 1/20 0.74
▸ PDPK1 O15530 1/20 0.74
▸ DAPK3 O43293 1/20 0.74
▸ DYRK3 O43781 1/20 0.74
▸ PRKD3 O94806 1/20 0.74
▸ MAP4K4 O95819 1/20 0.74
▸ CDK1 P06493 1/20 0.74
▸ CSF1R P07333 1/20 0.74
▸ PIM1 P11309 1/20 0.74
▸ PHKG2 P15735 1/20 0.74
▸ RPS6KB1 P23443 1/20 0.74
▸ CDK2 P24941 1/20 0.74
▸ TYK2 P29597 1/20 0.74
▸ AXL P30530 1/20 0.74
▸ FLT4 P35916 1/20 0.74
▸ KDR P35968 1/20 0.74
▸ FLT3 P36888 1/20 0.74

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
SCHEMBL5594436 0.89 MAPT (0.72) MAPTCDC7PLK4CHEK1PDPK1
SCHEMBL12351294 0.83 MAPT (0.83) MAPTCDC7PLK4CHEK1PDPK1
SCHEMBL5594542 0.83 MAPT (1.00) MAPTCDC7PLK4CHEK1PDPK1
SCHEMBL10476363 0.81 MEN1 (1.00) MAPTCDC7PLK4CHEK1PDPK1
SCHEMBL14749136 0.78 MAPT (0.76) MAPTCDC7PLK4CHEK1PDPK1
SCHEMBL17799204 0.78 MAPT (0.76) MAPTCDC7PLK4CHEK1PDPK1
SCHEMBL17799202 0.78 MAPT (0.76) MAPTCDC7PLK4CHEK1PDPK1
SCHEMBL14476502 0.78 MAPT (0.86) MAPTCDC7PLK4CHEK1PDPK1
SCHEMBL27983596 0.78 MAPT (0.78) MAPTKMT2AMEN1POLBUSP2
SCHEMBL5594463 0.77 MEN1 (0.67) MAPTCDC7PLK4CHEK1PDPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1778176-B1 COMPOSITION FOR COLOURING KERATIN-CONTAINING FIBRES HENKEL AG & CO KGAA (DE) 2012-07-25 — — EP disclosed
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