SCHEMBL7904908

SCHEMBL7904908

COC(=O)c1ccc(C(=O)c2cc(CC(C)O[Si](c3ccccc3)(c3ccccc3)C(C)(C)C)ccc2C)nc1

nearest known ligand 0.42

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 2/20 0.42
KDM4E B2RXH2 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.42
ABL1 P00519 1/20 0.34
S1PR4 O95977 1/20 0.34
S1PR3 Q99500 1/20 0.34
RARA P10276 1/20 0.33
RARB P10826 1/20 0.33
GCK P35557 1/20 0.33
PKM P14618 1/20 0.33
LTC4S Q16873 1/20 0.33
NPC1 O15118 1/20 0.32
RAB9A P51151 1/20 0.32
KMT2A Q03164 1/20 0.32
GABRA5 P31644 2/20 0.32
MME P08473 1/20 0.32
P4HTM Q9NXG6 1/20 0.32
SLC7A5 Q01650 1/20 0.32
LNPEP Q9UIQ6 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
SCHEMBL7911570 0.91 MAPK1 (0.41) MAPK1KDM4EL3MBTL1ABL1S1PR4
SCHEMBL7906285 0.81 MAPK1 (0.50) MAPK1KDM4EL3MBTL1PKMRAB9A
SCHEMBL7904907 0.80 MAPK1 (0.46) MAPK1KDM4EL3MBTL1ABL1S1PR4
SCHEMBL7906282 0.71 MAPK1 (0.53) MAPK1KDM4EL3MBTL1NPC1RAB9A
SCHEMBL21957970 0.69 TDP1 (0.43) KDM4EL3MBTL1PKMRAB9AGABRA5
SCHEMBL30746942 0.67 MAPK1 (0.46) MAPK1KDM4EL3MBTL1ABL1PKM
SCHEMBL6902498 0.65 RXRA (0.60) MAPK1KDM4EL3MBTL1RARARARB
Hydrochloric Acid SCHEMBL6553707 0.65 MAPK1 (0.96) MAPK1KDM4EL3MBTL1P4HTM
SCHEMBL5830575 0.65 KCNA5 (0.42) RAB9AKMT2A
SCHEMBL3779621 0.65 KCNA5 (0.42) RAB9AKMT2A

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 2 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-A1 MULTIBINDING AGENTS THAT MODULATE PPARη AND RXR RECEPTORS ADVANCED MEDICINE, INC. (US) 1999-12-16 WO disclosed