SCHEMBL8888085

SCHEMBL8888085

Cc1ccc(COc2cc3c(cc2CC=O)C(C)(C)CCC3(C)C)cc1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.40
HPGD P15428 2/20 0.40
ALDH1A1 P00352 2/20 0.40
LMNA P02545 2/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
MAOB P27338 7/20 0.39
MAOA P21397 4/20 0.39
NPC1 O15118 3/20 0.39
RAB9A P51151 3/20 0.39
RXRA P19793 3/20 0.38
GNRHR P30968 1/20 0.38
PTGER1 P34995 1/20 0.37
PTGER4 P35408 1/20 0.37
PTGER3 P43115 1/20 0.37
PTGER2 P43116 1/20 0.37
CYP1A2 P05177 2/20 0.36
CYP2C19 P33261 2/20 0.36
RECQL P46063 2/20 0.36
CISD1 Q9NZ45 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
SCHEMBL8890308 0.90 CCNB2 (0.40) MAPTSMN1; SMN2L3MBTL1MAOBMAOA
SCHEMBL8887456 0.89 NPC1 (0.42) HPGDSMN1; SMN2MAOBNPC1RAB9A
SCHEMBL8888740 0.87 APP (0.39) MAPTL3MBTL1MAOBRAB9ARXRA
SCHEMBL7156085 0.80 RXRA (0.48) LMNARXRAHNF4A
SCHEMBL727912 0.78 RXRA (0.46) RXRAHNF4A
SCHEMBL6915771 0.77 MAOB (0.49) MAPTSMN1; SMN2L3MBTL1MAOBMAOA
SCHEMBL6017468 0.77 RXRA (0.43) RXRAGNRHRHNF4A
SCHEMBL8890044 0.76 RXRA (0.35) MAPTALDH1A1RXRACYP3A4HNF4A
SCHEMBL8889198 0.75 RXRA (0.46) RXRAHNF4A
SCHEMBL8889384 0.74 RXRA (0.47) RXRAHNF4A

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-1997012853-A1 DIMER-SELECTIVE RXR MODULATORS AND METHODS FOR THEIR USE LIGAND PHARMACEUTICALS INCORPORATED (US) 1997-04-10 WO disclosed