SCHEMBL8477755

SCHEMBL8477755

COc1ccc(-c2c[c]c(C)c(-c3ccc(OC)c(C)c3)c2OCc2ccccc2)cc1C

nearest known ligand 0.46

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MGAM O43451 4/20 0.46
GAA P10253 4/20 0.46
SI P14410 4/20 0.46
MGAM2 Q2M2H8 4/20 0.46
MRGPRX4 Q96LA9 1/20 0.41
KDM4E B2RXH2 1/20 0.39
USP2 O75604 1/20 0.39
ALDH1A1 P00352 1/20 0.39
LMNA P02545 1/20 0.39
TSHR P16473 1/20 0.39
HSD17B10 Q99714 1/20 0.39
FFAR4 Q5NUL3 1/20 0.39
MAPT P10636 1/20 0.37
MAPK1 P28482 1/20 0.37
FFAR1 O14842 1/20 0.37
ERN1 O75460 2/20 0.36
PTPN1 P18031 1/20 0.36
BCHE P06276 1/20 0.36

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
SCHEMBL8474261 0.86 MGAM (0.42) MGAMGAASIMGAM2MRGPRX4
SCHEMBL8478958 0.85 MGAM (0.46) MGAMGAASIMGAM2MRGPRX4
SCHEMBL8480995 0.82 PTGS2 (0.35) MGAMGAASIMGAM2KDM4E
SCHEMBL8478292 0.81 MGAM (0.46) MGAMGAASIMGAM2ALDH1A1
SCHEMBL8477816 0.80 GAA (0.43) MGAMGAASIMGAM2ALDH1A1
SCHEMBL8480887 0.79 GAA (0.43) MGAMGAASIMGAM2LMNA
SCHEMBL8475146 0.73 MGAM (0.42) MGAMGAASIMGAM2MRGPRX4
SCHEMBL8474934 0.70 BCL2L2 (0.33) GAAKDM4EMAPTMAPK1ERN1
SCHEMBL8479650 0.70 TLR8 (0.36) MGAMGAASIMGAM2FFAR1
SCHEMBL13802180 0.69 MAOB (0.60) ALDH1A1LMNAMAPTFFAR1

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