SCHEMBL4544301

SCHEMBL4544301

C=C(C)C(=O)OC1CC2CC(C1)C(CC(O)(C(F)(F)F)C(F)(F)F)C2

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
SCHEMBL24383453 0.90 MEN1 (0.30) —
SCHEMBL24383449 0.89 — —
SCHEMBL24383550 0.82 — —
SCHEMBL524812 0.80 — —
SCHEMBL13906725 0.79 ALDH1A1 (0.31) —
SCHEMBL445380 0.79 — —
SCHEMBL24383454 0.78 — —
SCHEMBL24383567 0.76 — —
SCHEMBL24383451 0.76 — —
SCHEMBL22317681 0.75 ALDH1A1 (0.41) —

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8513457-B2 Fluorine-containing compound, fluorine-containing polymer, negative-type resist composition, and patterning process using same CENTRAL GLASS COMPANY, LIMITED (JP) 2013-08-20 — — US disclosed
US-8168366-B2 Low activation energy photoresist composition and process for its use INTERNATIONAL BUSINESS MACHINES CORPORATION (US) 2012-05-01 — — US disclosed
US-20110008727-A1 Low Activation Energy Photoresist Composition and Process for Its Use INTERNATIONAL BUSINESS MACHINES CORPORATION (US) 2011-01-13 — — US disclosed
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