SCHEMBL21910096

SCHEMBL21910096

COC(=O)C1C(C=O)C2CC1C1C2CC2C3CC(C4C(=O)OC(=O)C34)C21

nearest known ligand 0.00

⚠ Novel chemotype — no close known analogue (best Tanimoto < 0.3). Unexplored chemical space relative to ChEMBL.

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
SCHEMBL19440719 0.95 — —
SCHEMBL20626062 0.95 — —
SCHEMBL19334944 0.95 — —
SCHEMBL24076119 0.82 MEN1 (0.31) —
SCHEMBL21322369 0.74 SMN1; SMN2 (0.34) —
SCHEMBL18951234 0.74 — —
SCHEMBL12731670 0.72 KDM4E (0.41) —
SCHEMBL21475793 0.71 LMNA (0.32) —
SCHEMBL18807019 0.70 HSD11B1 (0.31) —
SCHEMBL13957510 0.70 POLB (0.32) —

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3125033-B1 LIQUID CRYSTAL DISPLAY DEVICE JNC CORP (JP) 2021-06-02 — — EP disclosed
EP-3179303-B1 LIQUID CRYSTAL DISPLAY ELEMENT JNC CORP (JP) 2020-04-01 — — EP disclosed
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