SCHEMBL6017346

SCHEMBL6017346

CC1(C)CCCc2ccc(CC=O)cc21

nearest known ligand 0.39

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
RXRA P19793 7/20 0.39
RXRB P28702 3/20 0.39
RXRG P48443 3/20 0.39
RARA P10276 2/20 0.39
RARB P10826 1/20 0.39
RARG P13631 1/20 0.39
MEN1 O00255 1/20 0.36
KMT2A Q03164 1/20 0.36
CYP26A1 O43174 1/20 0.35
CYP26B1 Q9NR63 1/20 0.35
KDM1A O60341 1/20 0.34
SIGMAR1 Q99720 4/20 0.33
PRKCD Q05655 2/20 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
SCHEMBL18740982 0.90 RARA (0.41) RXRARXRBRXRGRARARARB
SCHEMBL6017377 0.89 RXRA (0.39) RXRARXRBRXRGRARARARB
SCHEMBL8981801 0.81 RXRA (0.39) RXRARXRBRXRGMEN1KMT2A
SCHEMBL2091025 0.80 RXRA (0.41) RXRARXRBRXRGMEN1KMT2A
SCHEMBL13318246 0.80 KDM1A (0.39) RXRARXRBRXRGMEN1KMT2A
SCHEMBL4440994 0.80 RARA (0.56) RXRARXRBRXRGRARARARB
SCHEMBL18741112 0.79 ESR2 (0.41) RXRARXRBRXRGRARARARB
SCHEMBL2093706 0.77 PDK2 (0.38) RXRARXRBRXRGMEN1KMT2A
SCHEMBL9075009 0.77 RXRA (0.39) RXRARXRBRXRGRARARARB
SCHEMBL6507886 0.77 RXRA (0.40) RXRARXRBRXRGPRKCD

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-1704139-A1 DISUBSTITUTED CHALCONE OXIMES AS SELECTIVE AGONISTS OF RAR y RETINOID RECEPTORS Allergan, Inc. (US) 2006-09-27 EP disclosed
WO-2005066116-A1 DISUBSTITUTED CHALCONE OXIMES AS SELECTIVE AGONISTS OF RARϜ RETINOID RECEPTORS ALLERGAN, INC. (US) 2005-07-21 WO disclosed