SCHEMBL19440719

SCHEMBL19440719

COC(=O)[C@@H]1C2C[C@@H](C3C2C2C[C@@H]3C3C(=O)OC(=O)[C@H]23)[C@@H]1C=O

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
SCHEMBL20626062 1.00 — —
SCHEMBL19334944 1.00 — —
SCHEMBL21910096 0.95 — —
SCHEMBL24076119 0.79 MEN1 (0.31) —
SCHEMBL21322369 0.76 SMN1; SMN2 (0.34) —
SCHEMBL18951234 0.76 — —
SCHEMBL18807019 0.75 HSD11B1 (0.31) —
SCHEMBL21475793 0.73 LMNA (0.32) —
SCHEMBL13957510 0.72 POLB (0.32) —
SCHEMBL21318546 0.70 SLC6A3 (0.36) —

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-9783640-B2 Polyimide precursor, polyimide, polyimide film, varnish, and substrate UBE INDUSTRIES, LTD. (JP) 2017-10-10 — — US disclosed
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