SCHEMBL8569000

SCHEMBL8569000

C#Cc1cc(C23CC4CC(CC(C4)C2)C3)c(OCCCCCC)cc1OCCCCCC

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 7/20 0.38
CNR1 P21554 3/20 0.38
FAAH O00519 3/20 0.38
PPARG P37231 1/20 0.37
PPARD Q03181 1/20 0.37
PPARA Q07869 1/20 0.37
ALDH1A1 P00352 1/20 0.33
HPGD P15428 1/20 0.33
EPHX2 P34913 4/20 0.32
MEN1 O00255 1/20 0.31
NR1I2 O75469 1/20 0.31
LMNA P02545 1/20 0.31
PGR P06401 1/20 0.31
RARA P10276 1/20 0.31
HSPD1 P10809 1/20 0.31
RARB P10826 1/20 0.31
RARG P13631 1/20 0.31
GOT1 P17174 1/20 0.31
GLRA1 P23415 1/20 0.31
BLM P54132 1/20 0.31

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
SCHEMBL8571683 0.79 IKBKB (0.48) HPGDMEN1NR1I2LMNAPGR
SCHEMBL8572824 0.78 CNR2 (0.41) CNR2CNR1FAAHPPARGPPARD
SCHEMBL2832284 0.77 ALDH1A1 (0.44) ALDH1A1HPGDMEN1NR1I2LMNA
SCHEMBL3768573 0.77 ALDH1A1 (0.44) ALDH1A1HPGDMEN1NR1I2LMNA
SCHEMBL3267005 0.77 ALDH1A1 (0.44) ALDH1A1HPGDMEN1NR1I2LMNA
SCHEMBL766704 0.77 ALDH1A1 (0.44) ALDH1A1HPGDMEN1NR1I2LMNA
SCHEMBL8570403 0.76 LMNA (0.41) CNR2ALDH1A1MEN1NR1I2LMNA
SCHEMBL9331929 0.75 CNR2 (0.42) CNR2CNR1FAAHPPARGPPARD
SCHEMBL565429 0.75 CNR2 (0.42) CNR2CNR1FAAHPPARGPPARD
Hydrochloric Acid SCHEMBL11281821 0.75 CNR2 (0.40) CNR2CNR1FAAHPPARGPPARD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5798354-A COSMETIC, THERAPY CENTRE INTERNATIONAL DE RECHERCHES DERMATOLOGIQUES GALDERMA (FR) 1998-08-25 US disclosed
EP-0679631-B1 Biaromatic acetylated, an adamantyl group containing compounds, pharmaceutical and cosmetic compositions containing them and their use CIRD GALDERMA (FR) 1998-05-06 EP disclosed
US-5574036-A Adamantyl-substituted polycyclic acetylene compounds and pharmaceutical/cosmetic compositions comprised thereof CENTRE INTERNATIONAL DE RECHERCHES DERMATOLOGIQUES GALDERMA (FR) 1996-11-12 US disclosed
EP-0679631-A1 Biaromatic acetylated, an adamantyl group containing compounds, pharmaceutical and cosmetic compositions containing them and their use CENTRE INTERNATIONAL DE RECHERCHES DERMATOLOGIQUES GALDERMA, ( CIRD GALDERMA) (FR) 1995-11-02 EP disclosed