SCHEMBL24307019

SCHEMBL24307019

CC1(C)COB(c2ccc3c(ccc4ccccc43)c2)O1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LPL P06858 1/20 0.38
LIPG Q9Y5X9 1/20 0.38
ALDH1A1 P00352 5/20 0.38
HSD17B10 Q99714 3/20 0.38
CYP1B1 Q16678 2/20 0.38
HIF1A Q16665 1/20 0.38
HPRT1 P00492 3/20 0.36
CYP1A2 P05177 4/20 0.36
HPGD P15428 2/20 0.36
MAPT P10636 2/20 0.36
CYP1A1 P04798 1/20 0.36
CYP2A6 P11509 1/20 0.34
TSHR P16473 1/20 0.34
TDP1 Q9NUW8 1/20 0.34
FYN P06241 2/20 0.33
ACHE P22303 2/20 0.33
AHR P35869 2/20 0.33
ERBB2 P04626 1/20 0.33
MAOA P21397 1/20 0.33
LCK P06239 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
SCHEMBL22793668 0.93 LPL (0.39) LPLLIPGALDH1A1HSD17B10CYP1B1
SCHEMBL21341024 0.87 LPL (0.44) LPLLIPGALDH1A1HSD17B10HIF1A
SCHEMBL21879678 0.85 ALDH1A1 (0.40) LPLLIPGALDH1A1HSD17B10CYP1B1
SCHEMBL2261034 0.80 LPL (0.58) LPLLIPGALDH1A1HSD17B10CYP1B1
SCHEMBL28579068 0.80 HPRT1 (0.40) ALDH1A1HSD17B10CYP1B1HIF1AHPRT1
SCHEMBL24328655 0.80 ESR1 (0.31)
SCHEMBL24700308 0.80 LPL (0.31) LPLLIPG
SCHEMBL28575128 0.79 TRPM4 (0.33) LPLLIPGALDH1A1HSD17B10CYP1B1
SCHEMBL23419389 0.79 LPL (0.32) LPLLIPG
SCHEMBL25622442 0.79 LPL (0.56) LPLLIPGALDH1A1HSD17B10CYP1B1

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
US-20220123223-A1 ORGANIC ELECTROLUMINESCENT COMPOUND, A PLURALITY OF HOST MATERIALS AND ORGANIC ELECTROLUMINESCENT DEVICE COMPRISING THE SAME ROHM AND HAAS ELECTRONIC MATERIALS KOREA LTD. (KR) 2022-04-21 US disclosed