SCHEMBL29625591

SCHEMBL29625591

CC(C)(C)c1ccc2c(c1)c1cc(C(C)(C)C)ccc1n2-c1cc(-c2ccccc2)cc(-n2c3cc4ccccc4cc3c3c4ccccc4ccc32)c1Br

nearest known ligand 0.32

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ KIF11 P52732 1/20 0.32
▸ HTR6 P50406 2/20 0.31
▸ PGR P06401 1/20 0.31
▸ RORA P35398 1/20 0.31
▸ RORC P51449 1/20 0.31
▸ RORB Q92753 1/20 0.31
▸ MEN1 O00255 1/20 0.30
▸ POLB P06746 1/20 0.30
▸ GAA P10253 1/20 0.30
▸ KMT2A Q03164 1/20 0.30
▸ SERPINE1 P05121 1/20 0.30

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

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
SCHEMBL29625566 0.91 KIF11 (0.35) KIF11PGRRORARORCRORB
SCHEMBL29625612 0.91 KIF11 (0.35) KIF11PGRRORARORCRORB
SCHEMBL29625573 0.91 KIF11 (0.35) KIF11PGRRORARORCRORB
SCHEMBL29625572 0.90 PPARG (0.35) KIF11PGR
SCHEMBL29625556 0.90 KIF11 (0.38) KIF11MEN1POLBKMT2A
SCHEMBL29625631 0.89 KIF11 (0.33) KIF11PGRRORARORCRORB
SCHEMBL29625603 0.89 HTR6 (0.37) HTR6POLB
SCHEMBL29625610 0.87 PGR (0.35) KIF11PGRRORARORCRORB
SCHEMBL29625623 0.87 KIF11 (0.32) KIF11PGRRORARORCRORB
SCHEMBL26267308 0.83 SERPINE1 (0.36) SERPINE1

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
WO-2022131780-A1 ORGANIC LIGHT-EMITTING COMPOUND AND ORGANIC ELECTROLUMINESCENT ELEMENT USING SAME 솔루스첨단소재 주식회사 2022-06-23 — — WO disclosed
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