SCHEMBL27200722

SCHEMBL27200722

CCCOc1c(C)cc(-c2ccc3c(c2)CCC(C)(C)[C@@H]3NC(=O)O)cc1C

nearest known ligand 0.32

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RXRA P19793 2/20 0.32
GSTA1 P08263 2/20 0.32
GSTP1 P09211 2/20 0.32
CNR1 P21554 5/20 0.31
CNR2 P34972 5/20 0.31
ESR1 P03372 2/20 0.31
ESR2 Q92731 1/20 0.31
TP53 P04637 1/20 0.31
POLB P06746 1/20 0.31
MAPT P10636 1/20 0.31
PPARD Q03181 1/20 0.31
KDM4C Q9H3R0 1/20 0.31
LIPG Q9Y5X9 1/20 0.31
DGAT1 O75907 1/20 0.31
PPARG P37231 2/20 0.31
PPARA Q07869 2/20 0.31
RXRB P28702 1/20 0.31
RXRG P48443 1/20 0.31
NQO2 P16083 1/20 0.30
MTNR1A P48039 1/20 0.30

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
SCHEMBL23363477 1.00 RXRA (0.32) RXRAGSTA1GSTP1CNR1CNR2
SCHEMBL27029670 1.00 RXRA (0.32) RXRAGSTA1GSTP1CNR1CNR2
SCHEMBL27200789 0.95 PPARD (0.34) RXRAGSTA1GSTP1CNR1CNR2
SCHEMBL23363094 0.95 PPARD (0.34) RXRAGSTA1GSTP1CNR1CNR2
SCHEMBL27029681 0.95 PPARD (0.34) RXRAGSTA1GSTP1CNR1CNR2
SCHEMBL27029643 0.92 DGAT1 (0.32) RXRACNR1CNR2MAPTPPARD
SCHEMBL23362013 0.90 GSTA1 (0.33) GSTA1GSTP1CNR1CNR2TP53
SCHEMBL27029650 0.90 GSTA1 (0.33) GSTA1GSTP1CNR1CNR2TP53
SCHEMBL27029722 0.88 PPARD (0.40) PPARDKDM4CPPARANQO2MTNR1A
SCHEMBL27029660 0.86 CNR1 (0.40) CNR1CNR2DGAT1

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
EP-4041734-B1 DERIVATIVES HAVING 1,2,3,4-TETRAHYDRONAPHTHALENE MOIETY OR PHARMACEUTICALLY ACCEPTABLE SALT THEREOF AND PHARMACEUTICAL COMPOSITIONS COMPRISING THE SAME YUHAN CORP (KR) 2024-04-24 EP claimed