SCHEMBL7906282

SCHEMBL7906282

COC(=O)c1ccc(C(=O)c2cc(C(C)(C)O)ccc2C)nc1

nearest known ligand 0.53

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 2/20 0.53
KDM4E B2RXH2 1/20 0.53
L3MBTL1 Q9Y468 1/20 0.53
RAB9A P51151 2/20 0.38
NPC1 O15118 1/20 0.38
MAP3K5 Q99683 2/20 0.37
LMNA P02545 3/20 0.36
GAA P10253 2/20 0.36
MAPT P10636 2/20 0.36
NOTUM Q6P988 1/20 0.36
CYP11B2 P19099 1/20 0.35
CSF1R P07333 1/20 0.35
ALDH1A1 P00352 1/20 0.35
P4HTM Q9NXG6 1/20 0.35
SPR P35270 1/20 0.35
GPBAR1 Q8TDU6 1/20 0.35
TDP1 Q9NUW8 1/20 0.35

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
SCHEMBL7904907 0.81 MAPK1 (0.46) MAPK1KDM4EL3MBTL1RAB9ANPC1
SCHEMBL8199065 0.76 TDP1 (0.42) KDM4EL3MBTL1RAB9ANPC1LMNA
SCHEMBL7906285 0.76 MAPK1 (0.50) MAPK1KDM4EL3MBTL1RAB9ALMNA
SCHEMBL6902498 0.74 RXRA (0.60) MAPK1KDM4EL3MBTL1
SCHEMBL7904945 0.73 MAPK1 (0.44) MAPK1KDM4EL3MBTL1RAB9ANPC1
SCHEMBL64700 0.71 MAPK1 (1.00) MAPK1KDM4EL3MBTL1P4HTM
SCHEMBL69747 0.71 MAPK1 (1.00) MAPK1KDM4EL3MBTL1RAB9ANPC1
SCHEMBL29508473 0.71 MAPK1 (1.00) MAPK1KDM4EL3MBTL1RAB9ANPC1
SCHEMBL8688544 0.71 MAPK1 (0.43) MAPK1KDM4EL3MBTL1RAB9ANPC1
SCHEMBL4215082 0.71 MAPK1 (0.55) MAPK1KDM4EL3MBTL1RAB9ANPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1083888-A1 MULTIBINDING AGENTS THAT MODULATE PPARgamma AND RXR RECEPTORS Advanced Medicine, Inc. (US) 2001-03-21 EP disclosed
WO-1999063983-A9 MULTIBINDING AGENTS THAT MODULATE PPARη AND RXR RECEPTORS ADVANCED MEDICINE INC (US) 2000-03-23 WO disclosed
WO-1999063983-A1 MULTIBINDING AGENTS THAT MODULATE PPARη AND RXR RECEPTORS ADVANCED MEDICINE, INC. (US) 1999-12-16 WO disclosed