SCHEMBL29954459

SCHEMBL29954459

OCc1ccc(F)c(B(O)O)c1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP4F2 P78329 1/20 0.47
CYP4A11 Q02928 1/20 0.47
ENPP2 Q13822 1/20 0.44
HSD17B10 Q99714 1/20 0.37
KIF11 P52732 1/20 0.37
LPL P06858 2/20 0.34
LIPG Q9Y5X9 2/20 0.34
PRSS1 P07477 2/20 0.33
PRSS2 P07478 2/20 0.33
PRSS3 P35030 2/20 0.33
MAOA P21397 1/20 0.33
MAOB P27338 1/20 0.33
PTGER4 P35408 1/20 0.32
PTGDR2 Q9Y5Y4 1/20 0.32
SLC6A2 P23975 1/20 0.32
SLC6A4 P31645 1/20 0.32
CYP1A2 P05177 1/20 0.32
CYP2D6 P10635 1/20 0.32
CYP2C9 P11712 1/20 0.32
CYP2C19 P33261 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
SCHEMBL7962703 1.00 CYP4F2 (0.47) CYP4F2CYP4A11ENPP2HSD17B10KIF11
SCHEMBL29730087 0.83 ENPP2 (0.44) CYP4F2CYP4A11ENPP2HSD17B10KIF11
SCHEMBL2855228 0.83 LPL (0.48) LPLLIPGCYP1A2
SCHEMBL2295096 0.83 ENPP2 (0.44) CYP4F2CYP4A11ENPP2HSD17B10KIF11
SCHEMBL9939178 0.82 F11 (0.45) ENPP2MAOB
Hydrochloric Acid SCHEMBL31320925 0.80 F11 (0.48) ENPP2MAOB
Hydrochloric Acid SCHEMBL16396220 0.80 F11 (0.48) ENPP2MAOB
SCHEMBL16576648 0.79 ESR1 (0.44) HSD17B10LPLLIPGMAOAMAOB
SCHEMBL29955502 0.77 HPGD (0.47) HSD17B10CYP1A2CYP2C19
SCHEMBL24456142 0.77 ENPP2 (0.45) CYP4F2CYP4A11ENPP2HSD17B10LPL

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-119968355-A Cyclopentane compounds 橘生药品工业株式会社 2025-05-09 CN disclosed
CN-118339145-A Bicyclic fused ring derivatives or salts thereof and pharmaceutical compositions containing the same 柳韩洋行 2024-07-12 CN disclosed
CN-117083271-A Substituted thiadiazolyl derivatives as DNA polymerase theta inhibitors 伊迪亚生物科学有限公司 2023-11-17 CN disclosed
WO-2023055124-A1 BICYCLIC FUSED RING DERIVATIVE OR SALT THEREOF AND PHARMACEUTICAL COMPOSITION COMPRISING SAME 주식회사유한양행 2023-04-06 WO disclosed
US-20220340893-A1 BI-FUNCTIONAL COMPLEXES AND METHODS FOR MAKING AND USING SUCH COMPLEXES NUEVOLUTION A/S (DK) 2022-10-27 US disclosed