SCHEMBL8004090

SCHEMBL8004090

C[C@@H]1C[C@@]23C[C@H]1CC[C@@H]2[C@@]1(C)CC=C(C(=O)O)C(C)(C)[C@@H]1C[C@H]3O

nearest known ligand 0.30

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
▸ ERAP1 Q9NZ08 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
SCHEMBL8518059 1.00 ERAP1 (0.30) ERAP1
SCHEMBL123714 0.77 PTPN1 (0.33) —
SCHEMBL19260907 0.71 EGLN2 (0.38) —
SCHEMBL10945933 0.70 — —
SCHEMBL9952931 0.67 PAX8 (0.38) —
SCHEMBL12828226 0.56 NFKB1 (0.32) —
SCHEMBL3491364 0.55 PTPN1 (0.36) —
SCHEMBL2025216 0.53 PTGES (0.43) —
SCHEMBL6302003 0.51 HSD11B1 (0.33) —
SCHEMBL28158686 0.51 CCR2 (0.60) —

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-2000009722-A2 METHODS FOR CONTROLLING GIBBERELLIN LEVELS MONSANTO COMPANY (US) 2000-02-24 — — WO disclosed
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