SCHEMBL27343080

SCHEMBL27343080

CC1(C)OB(c2ccc3ccc4ccc5ccccc5c4c3n2)OC1(C)C

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ LPL P06858 2/20 0.39
▸ LIPG Q9Y5X9 2/20 0.39
▸ HSD17B10 Q99714 3/20 0.33
▸ HPGD P15428 2/20 0.33
▸ TSHR P16473 2/20 0.33
▸ CYP3A4 P08684 1/20 0.33
▸ MAPK1 P28482 1/20 0.33
▸ CASP1 P29466 1/20 0.33
▸ RAB9A P51151 1/20 0.33
▸ CASP7 P55210 1/20 0.33
▸ ATM Q13315 1/20 0.33
▸ HIF1A Q16665 1/20 0.33
▸ L3MBTL1 Q9Y468 1/20 0.33
▸ MEN1 O00255 1/20 0.32
▸ KMT2A Q03164 1/20 0.32
▸ ALDH1A1 P00352 2/20 0.32
▸ CYP1A2 P05177 2/20 0.32
▸ THRB P10828 1/20 0.32
▸ TDP1 Q9NUW8 2/20 0.31
▸ CYP2A6 P11509 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
SCHEMBL360716 0.89 LPL (0.42) LPLLIPGHSD17B10TSHRMAPK1
SCHEMBL31577401 0.85 HPRT1 (0.41) LPLLIPGHSD17B10TSHRCYP3A4
SCHEMBL22963565 0.85 HPRT1 (0.41) LPLLIPGHSD17B10TSHRCYP3A4
SCHEMBL14884183 0.81 MAPT (0.42) LPLLIPGTSHRCYP3A4RAB9A
SCHEMBL14884191 0.77 CYP3A4 (0.36) LPLLIPGTSHRCYP3A4MAPK1
SCHEMBL27343624 0.76 LPL (0.40) LPLLIPGHSD17B10HPGDTSHR
SCHEMBL27343841 0.76 LPL (0.40) LPLLIPGHSD17B10HPGDTSHR
SCHEMBL16026600 0.76 CCR1 (0.50) LPLLIPGTSHRCYP3A4RAB9A
SCHEMBL14884167 0.75 CCR1 (0.42) LPLLIPGTSHRCYP3A4RAB9A
SCHEMBL26435797 0.75 LPL (0.43) LPLLIPGHSD17B10HPGDTSHR

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-2024005486-A1 COMPOUND AND ORGANIC LIGHT-EMITTING ELEMENT COMPRISING SAME 주식회사 엘지화학 2024-01-04 — — WO disclosed
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