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SCHEMBL9118949

SCHEMBL9118949

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

nearest known ligand 0.69

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ FKBP1A P62942 18/20 0.69
▸ MEN1 O00255 1/20 0.68
▸ LMNA P02545 1/20 0.68
▸ MAPT P10636 1/20 0.68
▸ KMT2A Q03164 1/20 0.68
▸ THRB P10828 1/20 0.68
▸ FKBP4 Q02790 1/20 0.68
▸ ABCB11 O95342 1/20 0.66
▸ ADORA3 P0DMS8 1/20 0.66
▸ PPP3CA Q08209 1/20 0.63

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
SCHEMBL9288350 0.94 FKBP1A (0.71) FKBP1AMEN1LMNAMAPTKMT2A
SCHEMBL9118985 0.93 FKBP1A (0.71) FKBP1AMEN1LMNAMAPTKMT2A
SCHEMBL9119374 0.93 FKBP1A (0.66) FKBP1AMEN1LMNAMAPTKMT2A
SCHEMBL8918978 0.93 FKBP1A (0.68) FKBP1AMEN1LMNAMAPTKMT2A
SCHEMBL8780294 0.90 FKBP1A (0.79) FKBP1AMEN1LMNAMAPTKMT2A
SCHEMBL9094374 0.90 FKBP1A (0.85) FKBP1AMEN1LMNAMAPTKMT2A
SCHEMBL9109580 0.90 FKBP1A (0.79) FKBP1AMEN1LMNAMAPTKMT2A
SCHEMBL437514 0.89 FKBP1A (0.78) FKBP1AMEN1LMNAMAPTKMT2A
SCHEMBL9845154 0.89 FKBP1A (0.86) FKBP1AMEN1LMNAMAPTKMT2A
SCHEMBL8780286 0.89 FKBP1A (0.86) 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
WO-1995035299-A1 ARYL, ALKYL, ALKENYL AND ALKYNYLMACROLIDES HAVING IMMUNOSUPPRESSIVE ACTIVITY MERCK & CO., INC. (US) 1995-12-28 — — WO disclosed