SCHEMBL14972834

SCHEMBL14972834

CCOc1ccc2c(C(=O)C(=O)Nc3ccncc3)c(N=C=O)n(Cc3ccc(F)cc3)c2c1

nearest known ligand 0.43

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 5/20 0.43
▸ S1PR3 Q99500 7/20 0.42
▸ LMNA P02545 2/20 0.37
▸ HTT P42858 1/20 0.37
▸ FAAH O00519 1/20 0.37
▸ TP53 P04637 2/20 0.36
▸ NAMPT P43490 1/20 0.36

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
SCHEMBL14972847 0.94 MAPT (0.47) MAPTLMNAHTTFAAHTP53
SCHEMBL14972825 0.81 MAPT (0.47) MAPTLMNAFAAHTP53NAMPT
SCHEMBL5779675 0.73 S1PR3 (0.53) MAPTS1PR3
SCHEMBL4083537 0.73 FAAH (0.54) MAPTLMNAHTTFAAH
SCHEMBL2169462 0.72 FAAH (0.65) MAPTLMNAFAAH
SCHEMBL2993129 0.72 FAAH (0.51) MAPTLMNAHTTFAAH
SCHEMBL2160503 0.71 FAAH (0.50) MAPTLMNAFAAHTP53
SCHEMBL6255149 0.70 TUBB4A (0.48) MAPTLMNAFAAHTP53
SCHEMBL3847524 0.69 FAAH (0.54) MAPTLMNAFAAHTP53NAMPT
SCHEMBL4378390 0.69 FAAH (0.48) MAPTFAAH

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-1809279-B1 PARTICULATE COMPOSITIONS OF TUBULIN INHIBITOR BAXTER INT (US) 2013-05-29 — — EP claimed
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