SCHEMBL8479563

SCHEMBL8479563

Cc1c(CCO)[c]c(-c2ccccc2)c(-c2ccccc2)c1OCc1ccccc1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP4F2 P78329 1/20 0.42
CYP4A11 Q02928 1/20 0.42
GAA P10253 5/20 0.39
MGAM O43451 4/20 0.39
SI P14410 4/20 0.39
MGAM2 Q2M2H8 4/20 0.39
TDP1 Q9NUW8 2/20 0.37
L3MBTL1 Q9Y468 2/20 0.37
MAPT P10636 1/20 0.37
MAPK1 P28482 1/20 0.37
PTPN1 P18031 1/20 0.36
LTA4H P09960 1/20 0.36
EPHX2 P34913 1/20 0.36
LMNA P02545 2/20 0.34
POLB P06746 1/20 0.34
PTGER1 P34995 1/20 0.34
PTGER4 P35408 1/20 0.34
PTGER3 P43115 1/20 0.34
PTGER2 P43116 1/20 0.34
FFAR1 O14842 1/20 0.33

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
SCHEMBL8474508 0.94 CYP4F2 (0.39) CYP4F2CYP4A11GAAMGAMSI
SCHEMBL8475245 0.89 MAPT (0.38) GAAMGAMSIMGAM2TDP1
SCHEMBL8475256 0.86 L3MBTL1 (0.40) GAAMGAMSIMGAM2TDP1
SCHEMBL8477547 0.81 L3MBTL1 (0.42) GAAMGAMSIMGAM2TDP1
SCHEMBL8475020 0.77 NPSR1 (0.40) GAAMGAMSIMGAM2MAPT
SCHEMBL8474276 0.77 TDP1 (0.34) GAATDP1MAPK1HPGD
SCHEMBL8476215 0.76 PDE4B (0.42) GAAMGAMSIMGAM2TDP1
SCHEMBL8480765 0.75 MGAM (0.41) GAAMGAMSIMGAM2
SCHEMBL8480711 0.74 MGAM (0.43) GAAMGAMSIMGAM2
SCHEMBL8479030 0.74 GAA (0.44) GAAMGAMSIMGAM2TDP1

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-6004988-A Carboxylic acid derivatives, their preparation and their use BASF AKTIENGESELLSCHAFT (DE) 1999-12-21 US disclosed