SCHEMBL30569512

SCHEMBL30569512

CC(C)(C)c1ccc(Nc2ccc(C(C)(C)C)cc2B2OC(C)(C)C(C)(C)O2)cc1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ AKR1C3 P42330 2/20 0.39
▸ AKR1C2 P52895 2/20 0.39
▸ HIF1A Q16665 1/20 0.38
▸ SLC2A1 P11166 1/20 0.34
▸ PTGIR P43119 1/20 0.34
▸ CA1 P00915 2/20 0.33
▸ CA2 P00918 2/20 0.33
▸ CA9 Q16790 2/20 0.33
▸ CA12 O43570 1/20 0.33
▸ CA3 P07451 1/20 0.33
▸ CA4 P22748 1/20 0.33
▸ CA6 P23280 1/20 0.33
▸ CA5A P35218 1/20 0.33
▸ CA7 P43166 1/20 0.33
▸ CA14 Q9ULX7 1/20 0.33
▸ CA5B Q9Y2D0 1/20 0.33
▸ LIPE Q05469 1/20 0.32
▸ FGFR2 P21802 3/20 0.32
▸ CSNK1D P48730 2/20 0.32
▸ CSNK1G2 P78368 2/20 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
SCHEMBL24126531 1.00 AKR1C3 (0.39) AKR1C3AKR1C2HIF1ASLC2A1PTGIR
SCHEMBL25213302 0.89 HIF1A (0.40) AKR1C3AKR1C2HIF1ASLC2A1CA1
SCHEMBL26599940 0.89 HIF1A (0.38) AKR1C3AKR1C2HIF1ASLC2A1PTGIR
SCHEMBL20829080 0.86 LIPE (0.40) AKR1C3AKR1C2HIF1ASLC2A1CA1
SCHEMBL26599255 0.84 CYP26A1 (0.36) HIF1ALIPEMEN1KMT2A
SCHEMBL26599492 0.82 HIF1A (0.36) AKR1C3AKR1C2HIF1ASLC2A1PTGIR
SCHEMBL22646194 0.79 MAPK1 (0.44) AKR1C3AKR1C2LIPEMEN1MAPT
SCHEMBL29074784 0.78 KDM4E (0.41) AKR1C3AKR1C2LIPEMEN1MAPT
SCHEMBL30569503 0.77 HPGD (0.38) HIF1AMEN1MAPTKMT2A
SCHEMBL25254653 0.77 HIF1A (0.32) AKR1C3AKR1C2HIF1A

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20250268015-A1 COMPOUND AND ORGANIC LIGHT EMITTING DEVICE COMPRISING SAME LG CHEM, LTD. (KR) 2025-08-21 — — US disclosed
WO-2023172110-A1 COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE COMPRISING SAME 주식회사 엘지화학 2023-09-14 — — WO disclosed
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