SCHEMBL21029523

SCHEMBL21029523

Bn1c(C=C)c(C=C)c(C=C)c1C=C

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
SCHEMBL18656848 0.69 — —
SCHEMBL22509665 0.69 — —
SCHEMBL23336278 0.67 — —
SCHEMBL19805233 0.63 — —
SCHEMBL5831499 0.62 ALDH1A1 (0.36) —
SCHEMBL19999059 0.61 — —
SCHEMBL18715944 0.61 — —
SCHEMBL8979429 0.54 VCP (0.31) —
SCHEMBL9838347 0.51 — —
SCHEMBL19706178 0.51 — —

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-11678572-B2 Compound for organic optoelectronic device, composition for organic optoelectronic device, organic optoelectronic device and display apparatus SAMSUNG SDI CO., LTD. (KR) 2023-06-13 — — US disclosed
US-20190165281-A1 COMPOUND FOR ORGANIC OPTOELECTRONIC DEVICE, COMPOSITION FOR ORGANIC OPTOELECTRONIC DEVICE, ORGANIC OPTOELECTRONIC DEVICE AND DISPLAY APPARATUS SAMSUNG SDI CO., LTD. (KR) 2019-05-30 — — US disclosed
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