SCHEMBL18951234

SCHEMBL18951234

COC(=O)C1C(CC=O)C2CC1C1C3CCC(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
SCHEMBL18807521 0.93 PPM1B (0.30) —
SCHEMBL20626062 0.76 — —
SCHEMBL19334944 0.76 — —
SCHEMBL19440719 0.76 — —
SCHEMBL21910096 0.74 — —
SCHEMBL19110608 0.69 ALDH1A1 (0.33) —
SCHEMBL21943781 0.68 PPM1B (0.41) —
SCHEMBL19687880 0.67 KDM4E (0.44) —
SCHEMBL19687884 0.67 KDM4E (0.44) —
SCHEMBL12172588 0.67 KDM4E (0.44) —

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-3179303-B1 LIQUID CRYSTAL DISPLAY ELEMENT JNC CORP (JP) 2020-04-01 — — EP disclosed
EP-3179303-A1 LIQUID CRYSTAL DISPLAY ELEMENT JNC Corporation (JP) 2017-06-14 — — EP disclosed
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