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SCHEMBL9694342

SCHEMBL9694342

CCC1/C=C(\C)CC(C)CC(OC)C2OC(O)(C(=O)C(=O)N3CCCCC3C(=O)OC(C(C)=CC3CCC(OC)C(O)C3)C(C)C(O[Si](C(C)C)(C(C)C)C(C)C)CC1=O)C(C)CC2OC

nearest known ligand 0.82

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ FKBP1A P62942 18/20 0.82
▸ MEN1 O00255 1/20 0.79
▸ LMNA P02545 1/20 0.79
▸ MAPT P10636 1/20 0.79
▸ KMT2A Q03164 1/20 0.79
▸ THRB P10828 1/20 0.79
▸ FKBP4 Q02790 1/20 0.79
▸ ABCB11 O95342 1/20 0.77
▸ ADORA3 P0DMS8 1/20 0.77

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
SCHEMBL9695545 0.97 FKBP1A (0.87) FKBP1AMEN1LMNAMAPTKMT2A
SCHEMBL9093562 0.96 FKBP1A (0.79) FKBP1AMEN1LMNAMAPTKMT2A
SCHEMBL9094679 0.96 FKBP1A (0.86) FKBP1AMEN1LMNAMAPTKMT2A
SCHEMBL9694314 0.96 FKBP1A (0.79) FKBP1AMEN1LMNAMAPTKMT2A
SCHEMBL9694371 0.95 FKBP1A (0.77) FKBP1AMEN1LMNAMAPTKMT2A
SCHEMBL9694356 0.95 FKBP1A (0.85) FKBP1AMEN1LMNAMAPTKMT2A
SCHEMBL9562642 0.93 FKBP1A (0.75) FKBP1AMEN1LMNAMAPTKMT2A
SCHEMBL9695757 0.92 FKBP1A (0.79) FKBP1AMEN1LMNAMAPTKMT2A
SCHEMBL9694349 0.92 FKBP1A (0.72) FKBP1AMEN1LMNAMAPTKMT2A
SCHEMBL9710245 0.92 FKBP1A (0.87) FKBP1AMEN1LMNAMAPTKMT2A

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-0480623-A1 New halomacrolides and derivatives having immunosuppressive activity MERCK & CO. INC. (US) 1992-04-15 — — EP disclosed