SCHEMBL22097271

SCHEMBL22097271

CC(C)(C)c1ccc2c(c1)c1cc(C(C)(C)C)ccc1n2-c1cc(-c2ccccc2)cc(-c2ncc(-c3ccc4c(c3)c3ccccc3c3cc5c(cc43)sc3ccccc35)cn2)c1

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
SCHEMBL22097019 0.89 — —
SCHEMBL22097274 0.83 ALDH1A1 (0.33) —
SCHEMBL17878936 0.79 — —
SCHEMBL17885400 0.77 PTPN7 (0.38) —
SCHEMBL22131353 0.77 KDM4E (0.31) —
SCHEMBL22131341 0.77 KDM4E (0.31) —
SCHEMBL24812228 0.77 PMM2 (0.39) —
SCHEMBL15582930 0.77 KDM4E (0.38) —
SCHEMBL17691649 0.76 SERPINE1 (0.34) —
SCHEMBL17736888 0.76 KDM4E (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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11236075-B2 Organic compound and organic electroluminescence device using the same LUMINESCENCE TECHNOLOGY CORP. (TW) 2022-02-01 — — US disclosed
US-20200190065-A1 ORGANIC COMPOUND AND ORGANIC ELECTROLUMINESCENCE DEVICE USING THE SAME LUMINESCENCE TECHNOLOGY CORPORATION (TW) 2020-06-18 — — US disclosed
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