SCHEMBL18565978

SCHEMBL18565978

CC1(C)c2ccccc2-c2cc(-c3ccc4c(c3)c3ccccc3n4-c3cc4c5c(c3)C(C)(C)c3cc(-c6cc(-n7c8ccccc8c8cc(-c9ccc%10c(c9)-c9ccccc9C%10(C)C)ccc87)nc(-n7c8ccccc8c8cc(-c9ccc%10c(c9)-c9ccccc9C%10(C)C)ccc87)n6)cc(c3-5)C4(C)C)ccc21

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
SCHEMBL18588493 0.92 — —
SCHEMBL18565959 0.92 — —
SCHEMBL18565974 0.91 — —
SCHEMBL18565976 0.91 — —
SCHEMBL15395019 0.91 KDM4E (0.34) —
SCHEMBL18565950 0.91 — —
SCHEMBL18565971 0.89 — —
SCHEMBL18565970 0.89 — —
SCHEMBL18565968 0.88 — —
SCHEMBL18565937 0.88 TUBB4A (0.33) —

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-10290815-B2 Composition, compound, material for organic electroluminescence element, ink composition, organic electroluminescence element, and electronic device IDEMITSU KOSAN CO., LTD. (JP) 2019-05-14 — — US disclosed
US-20170062733-A1 COMPOSITION, COMPOUND, MATERIAL FOR ORGANIC ELECTROLUMINESCENCE ELEMENT, INK COMPOSITION, ORGANIC ELECTROLUMINESCENCE ELEMENT, AND ELECTRONIC DEVICE IDEMITSU KOSAN CO., LTD. (JP) 2017-03-02 — — US disclosed
US-20170062733-A1 COMPOSITION, COMPOUND, MATERIAL FOR ORGANIC ELECTROLUMINESCENCE ELEMENT, INK COMPOSITION, ORGANIC ELECTROLUMINESCENCE ELEMENT, AND ELECTRONIC DEVICE IDEMITSU KOSAN CO., LTD. (JP) 2017-03-02 — — US disclosed
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