SCHEMBL24517441

SCHEMBL24517441

Bc1c(O)c(O)c(O)c2c(O)c(O)c(-c3ccc4ccccc4c3C)c(O)c12

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TSHR P16473 2/20 0.38
▸ CYP1A2 P05177 1/20 0.38
▸ CYP2A6 P11509 1/20 0.38
▸ RAB9A P51151 3/20 0.35
▸ L3MBTL1 Q9Y468 2/20 0.35
▸ CYP3A4 P08684 2/20 0.35
▸ HPGD P15428 1/20 0.35
▸ MAPK1 P28482 1/20 0.35
▸ CASP1 P29466 1/20 0.35
▸ CASP7 P55210 1/20 0.35
▸ ATM Q13315 1/20 0.35
▸ HIF1A Q16665 1/20 0.35
▸ HSD17B10 Q99714 1/20 0.35
▸ PTPN22 Q9Y2R2 1/20 0.34
▸ DNMT1 P26358 1/20 0.33
▸ MEN1 O00255 4/20 0.32
▸ KMT2A Q03164 4/20 0.32
▸ NPC1 O15118 1/20 0.32
▸ MAPT P10636 3/20 0.32
▸ TP53 P04637 1/20 0.32

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
SCHEMBL24517442 0.82 TSHR (0.39) TSHRCYP1A2CYP2A6RAB9AL3MBTL1
SCHEMBL26500488 0.70 NQO1 (0.31) —
SCHEMBL16882425 0.67 TSHR (0.63) TSHRCYP1A2CYP2A6RAB9AL3MBTL1
SCHEMBL25667272 0.65 LMNA (0.32) MEN1KMT2AMAPTSMN1; SMN2
SCHEMBL16062615 0.65 TSHR (0.59) TSHRCYP1A2CYP2A6RAB9AL3MBTL1
SCHEMBL27457373 0.64 CYP1A2 (0.48) TSHRCYP1A2CYP2A6RAB9AL3MBTL1
SCHEMBL8598202 0.64 TSHR (0.58) TSHRCYP1A2CYP2A6RAB9AL3MBTL1
SCHEMBL27267757 0.64 GPR84 (0.39) TSHRCYP1A2L3MBTL1HPGDMAPK1
SCHEMBL25667243 0.64 MEN1 (0.37) MEN1KMT2AMAPTSMN1; SMN2
SCHEMBL1150948 0.63 PTPN22 (0.52) TSHRCYP1A2CYP2A6RAB9AHPGD

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-2022124845-A1 ORGANIC LUMINESCENT COMPOUND, AND ORGANIC ELECTROLUMINESCENT ELEMENT COMPRISING SAME 솔루스첨단소재 주식회사 2022-06-16 — — WO disclosed
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