SCHEMBL24865069

SCHEMBL24865069

O=C(c1c(O)c2cccc(-c3ccccc3)c2oc1=O)C(F)(F)F

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ADORA3 P0DMS8 3/20 0.41
ADORA2A P29274 3/20 0.41
ADORA1 P30542 3/20 0.41
GPR35 Q9HC97 1/20 0.40
CA12 O43570 1/20 0.39
CA9 Q16790 1/20 0.39
PRKDC P78527 4/20 0.38
CDC14B O60729 1/20 0.38
CDC14A Q9UNH5 1/20 0.38
HNF4A P41235 1/20 0.37
ALDH1A1 P00352 3/20 0.37
KDM4E B2RXH2 2/20 0.37
PIK3CD O00329 2/20 0.37
BRD4 O60885 2/20 0.37
BRD2 P25440 2/20 0.37
PIK3CA P42336 2/20 0.37
PIK3CB P42338 2/20 0.37
PIK3CG P48736 2/20 0.37
BRD3 Q15059 2/20 0.37
SMN1; SMN2 Q16637 2/20 0.37

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
SCHEMBL24865061 0.79 CA12 (0.36) GPR35CA12CA9ALDH1A1KDM4E
SCHEMBL24865062 0.79 CA12 (0.36) CA12CA9ALDH1A1KDM4ESMN1; SMN2
SCHEMBL24864748 0.79 HPGD (0.47) ADORA1CA12CA9PRKDCALDH1A1
SCHEMBL933166 0.77
SCHEMBL11478429 0.76 ADORA3 (0.48) ADORA3ADORA2AADORA1GPR35PRKDC
SCHEMBL24864745 0.76 CA12 (0.65) GPR35CA12CA9ALDH1A1KDM4E
SCHEMBL24865030 0.76 CA12 (0.47) CA12CA9CDC14BCDC14AALDH1A1
SCHEMBL24864903 0.75 LMNA (0.40) CA12CA9ALDH1A1KDM4ESMN1; SMN2
SCHEMBL24865018 0.74 CA12 (0.45) CA12CA9ALDH1A1KDM4ESMN1; SMN2
SCHEMBL24865044 0.74 CA12 (0.45) CA12CA9ALDH1A1KDM4ESMN1; SMN2

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
WO-2023282236-A1 RARE EARTH COMPLEX 東ソー株式会社 2023-01-12 WO disclosed