SCHEMBL6670378

SCHEMBL6670378

CCCCN(C(=O)[C@@H](NC)C(C)(C)c1ccccc1)[C@H](C(=O)N(C)[C@H](/C=C(\C)C(=O)OCC)C(C)C)C(C)(C)C

nearest known ligand 0.46

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ TUBB1 Q9H4B7 2/20 0.46
▸ TXNRD1 Q16881 1/20 0.32

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
SCHEMBL14568137 0.82 TUBB1 (0.67) TUBB1
SCHEMBL13682076 0.82 TUBB1 (0.67) TUBB1
SCHEMBL58750 0.82 TUBB1 (0.67) TUBB1
SCHEMBL5980725 0.82 TUBB1 (0.67) TUBB1
SCHEMBL57979 0.82 TUBB1 (0.67) TUBB1
SCHEMBL57410 0.82 TUBB1 (0.67) TUBB1
SCHEMBL58344 0.82 TUBB1 (0.67) TUBB1
SCHEMBL14591405 0.82 TUBB1 (0.67) TUBB1
SCHEMBL14186137 0.82 TUBB1 (0.67) TUBB1
SCHEMBL6799344 0.80 TUBB1 (0.64) TUBB1

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
WO-2004026293-A2 HEMIASTERLIN DERIVATIVES FOR TREATING RESISTANT TUMORS WYETH HOLDINGS CORPORATION (US) 2004-04-01 — — WO disclosed
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