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Sugi Predict / Compounds / SCHEMBL2713600

SCHEMBL2713600

SCHEMBL2713600

CC(=O)N1CCN(c2cccc(CC(=O)Nc3cc(N(c4ccccc4)C4CC4)c(C(N)=O)cn3)c2)CC1

nearest known ligand 0.48

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ WNT3A P56704 17/20 0.48
▸ SYK P43405 2/20 0.42
▸ RORC P51449 1/20 0.40

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
SCHEMBL2716322 0.86 SYK (0.47) SYK
SCHEMBL2713978 0.81 SYK (0.54) SYK
SCHEMBL2693764 0.79 WNT3A (0.48) WNT3ASYK
SCHEMBL2712360 0.75 SYK (0.45) SYK
SCHEMBL2714011 0.75 SYK (0.51) SYK
SCHEMBL2712299 0.75 SYK (0.55) SYK
SCHEMBL2716479 0.71 SYK (0.53) SYK
SCHEMBL22953919 0.71 WNT3A (0.69) WNT3A
SCHEMBL2713668 0.70 SYK (0.46) SYKRORC
SCHEMBL2713612 0.70 MAPK10 (0.55) SYK

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2635557-A2 NICOTINAMIDES AS JAK KINASE MODULATORS Portola Pharmaceuticals, Inc. (US) 2013-09-11 — — EP claimed
WO-2012061428-A2 NICOTINAMIDES AS JAK KINASE MODULATORS PORTOLA PHARMACEUTICALS, INC. (US) 2012-05-10 — — WO claimed
EP-2635557-A2 NICOTINAMIDES AS JAK KINASE MODULATORS Portola Pharmaceuticals, Inc. (US) 2013-09-11 — — EP disclosed
WO-2012061428-A2 NICOTINAMIDES AS JAK KINASE MODULATORS PORTOLA PHARMACEUTICALS, INC. (US) 2012-05-10 — — WO disclosed
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