SCHEMBL16994732

SCHEMBL16994732

CC(=O)COCC(=O)NCCOCCOCCOCCOCCOCCOCCOCCOCCn1cc(CNC(=O)[C@H]2CC[C@H](CN3C(=O)C=CC3=O)CC2)nn1

nearest known ligand 0.55

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ TTR P02766 1/20 0.55
▸ IL2 P60568 1/20 0.55
▸ F2RL1 P55085 1/20 0.33
▸ OPRM1 P35372 1/20 0.33
▸ PLK1 P53350 2/20 0.32
▸ PLK2 Q9NYY3 1/20 0.32
▸ GBA1 P04062 1/20 0.31
▸ MEN1 O00255 1/20 0.31
▸ LMNA P02545 1/20 0.31
▸ HPGD P15428 1/20 0.31
▸ MAPK10 P53779 1/20 0.31
▸ KMT2A Q03164 1/20 0.31
▸ PKM P14618 1/20 0.31
▸ LGALS3 P17931 1/20 0.30

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
SCHEMBL17874493 1.00 TTR (0.55) TTRIL2F2RL1OPRM1PLK1
SCHEMBL18772725 0.94 TTR (0.55) TTRIL2F2RL1OPRM1PLK1
SCHEMBL17011377 0.93 TTR (0.56) TTRIL2F2RL1OPRM1PLK1
SCHEMBL13684272 0.90 TTR (0.46) TTRIL2F2RL1OPRM1PLK1
SCHEMBL12342488 0.90 TTR (0.46) TTRIL2F2RL1OPRM1PLK1
SCHEMBL25559708 0.89 TTR (0.45) TTRIL2F2RL1OPRM1GBA1
SCHEMBL12342507 0.88 TTR (0.51) TTRIL2F2RL1OPRM1PLK1
SCHEMBL30645075 0.84 TTR (0.52) TTRIL2F2RL1GBA1
SCHEMBL14129407 0.83 TTR (0.45) TTRIL2F2RL1OPRM1GBA1
SCHEMBL13684277 0.82 TTR (0.42) TTRIL2

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
US-9102735-B2 Immunoconjugates with an intracellularly-cleavable linkage IMMUNOMEDICS, INC. (US) 2015-08-11 — — US disclosed
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