SCHEMBL31643544

SCHEMBL31643544

CC1(C)OB(c2cc(-c3ccc(C#N)cc3)ccc2-c2ccccc2-c2nc(-c3ccccc3)nc(-c3ccc4oc5ccccc5c4c3)n2)OC1(C)C

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TNKS O95271 1/20 0.34
▸ ABCG2 Q9UNQ0 8/20 0.33
▸ MEN1 O00255 2/20 0.33
▸ ALDH1A1 P00352 2/20 0.33
▸ CYP1A2 P05177 2/20 0.33
▸ CYP3A4 P08684 2/20 0.33
▸ CYP2C19 P33261 2/20 0.33
▸ KMT2A Q03164 2/20 0.33
▸ CLK4 Q9HAZ1 2/20 0.33
▸ LMNA P02545 1/20 0.33
▸ CYP2D6 P10635 1/20 0.33
▸ CYP2C9 P11712 1/20 0.33
▸ TSHR P16473 1/20 0.33
▸ HSD17B10 Q99714 1/20 0.33
▸ ABCB1 P08183 4/20 0.32
▸ LPL P06858 2/20 0.32
▸ LIPG Q9Y5X9 2/20 0.32
▸ HRH3 Q9Y5N1 5/20 0.32
▸ MAPK1 P28482 1/20 0.32
▸ PGR P06401 1/20 0.31

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
SCHEMBL31643430 0.90 LPL (0.39) ABCG2ABCB1LPLLIPGPGR
SCHEMBL31643719 0.89 LPL (0.37) ABCG2MEN1ALDH1A1CYP1A2CYP3A4
SCHEMBL31643730 0.85 LPL (0.37) ABCG2MEN1ALDH1A1CYP1A2CYP3A4
SCHEMBL32682798 0.83 ABCG2 (0.38) ABCG2MEN1ALDH1A1CYP1A2CYP3A4
SCHEMBL31643640 0.82 TNKS (0.39) TNKSABCG2MEN1ALDH1A1CYP1A2
SCHEMBL31643748 0.82 LPL (0.39) ABCG2MEN1ALDH1A1CYP1A2CYP3A4
SCHEMBL31643463 0.82 LPL (0.38) MEN1ALDH1A1KMT2ALMNATSHR
SCHEMBL31643522 0.82 TNKS (0.38) TNKSABCG2MEN1ALDH1A1CYP1A2
SCHEMBL23730994 0.78 PGR (0.39) MEN1ALDH1A1KMT2ALMNATSHR
SCHEMBL21236415 0.78 LPL (0.40) MEN1ALDH1A1KMT2ALMNATSHR

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-2025135555-A1 ORGANIC LIGHT-EMITTING COMPOUND, AND ORGANIC ELECTROLUMINESCENT DEVICE COMPRISING SAME 솔루스첨단소재 주식회사 2025-06-26 — — WO disclosed
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