SCHEMBL9766774

SCHEMBL9766774

CC(C)CCC[C@@H](C)[C@H]1CC[C@@]2(CC(=O)O)C3=C(CC[C@]12C)[C@@]1(C)CC[C@H](OC(=O)c2ccccc2)C(C)(C)C1CC3

nearest known ligand 0.48

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 3/20 0.48
▸ USP2 O75604 2/20 0.48
▸ ALDH1A1 P00352 2/20 0.48
▸ CYP3A4 P08684 2/20 0.48
▸ ALOX15 P16050 2/20 0.48
▸ BACE1 P56817 1/20 0.43
▸ PTGES O14684 1/20 0.43
▸ CRYAB P02511 5/20 0.40
▸ CRYAA P02489 1/20 0.40
▸ PIN1 Q13526 1/20 0.38
▸ LMNA P02545 1/20 0.37
▸ EBP Q15125 3/20 0.37
▸ NR1H4 Q96RI1 1/20 0.36
▸ MEN1 O00255 1/20 0.36
▸ PLA2G1B P04054 1/20 0.36
▸ DNMT1 P26358 1/20 0.36
▸ BLM P54132 1/20 0.36
▸ KMT2A Q03164 1/20 0.36
▸ ATG4B Q9Y4P1 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
SCHEMBL9766769 1.00 MAPT (0.48) MAPTUSP2ALDH1A1CYP3A4ALOX15
SCHEMBL9766806 0.87 MAPT (0.49) MAPTUSP2ALDH1A1CYP3A4ALOX15
SCHEMBL9766812 0.87 MAPT (0.49) MAPTUSP2ALDH1A1CYP3A4ALOX15
SCHEMBL9769622 0.85 MAPT (0.47) MAPTUSP2ALDH1A1CYP3A4ALOX15
SCHEMBL9644062 0.84 MAPT (0.45) MAPTUSP2ALDH1A1CYP3A4ALOX15
SCHEMBL9644065 0.84 MAPT (0.45) MAPTUSP2ALDH1A1CYP3A4ALOX15
SCHEMBL9766870 0.83 CRYAB (0.58) MAPTUSP2ALDH1A1CYP3A4ALOX15
SCHEMBL9766873 0.83 CRYAB (0.58) MAPTUSP2ALDH1A1CYP3A4ALOX15
SCHEMBL9766748 0.81 USP2 (0.40) MAPTUSP2ALDH1A1CYP3A4ALOX15
SCHEMBL9766742 0.81 USP2 (0.40) MAPTUSP2ALDH1A1CYP3A4ALOX15

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-5023250-A Anticholesterol agents SMITHKLINE BEECHAM CORPORATION (US) 1991-06-11 — — US disclosed
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