SCHEMBL22877988

SCHEMBL22877988

C=C1CC(O)C2C(C)C(=O)OC2C2CC(O)CC12

nearest known ligand 0.42

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ MAPK1 P28482 1/20 0.41
▸ LMNA P02545 1/20 0.41
▸ CYP1A2 P05177 1/20 0.41

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
SCHEMBL10307521 0.80 MAPK1 (0.41) MAPK1LMNACYP1A2
SCHEMBL10307511 0.78 MAPK1 (0.42) MAPK1LMNACYP1A2
SCHEMBL30174115 0.78 MAPK1 (0.42) MAPK1LMNACYP1A2
SCHEMBL10307516 0.77 MAPK1 (0.40) MAPK1LMNACYP1A2
SCHEMBL12459727 0.76 MAPK1 (0.41) MAPK1LMNACYP1A2
SCHEMBL10099627 0.64 — —
SCHEMBL15738259 0.62 TAS2R46 (0.47) LMNACYP1A2
SCHEMBL13460251 0.62 — —
SCHEMBL28272103 0.61 — —
SCHEMBL12204304 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
EP-3763419-A1 CHEMOSENSORY RECEPTOR LIGAND-BASED THERAPIES Anji Pharma (US) LLC (US) 2021-01-13 — — EP disclosed
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