SCHEMBL8575202

SCHEMBL8575202

CCCCCCCOc1ccc(C#Cc2ccc(C(=O)OC)cc2)cc1C12CC3CC(CC(C3)C1)C2

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PPARG P37231 1/20 0.46
PPARD Q03181 1/20 0.46
PPARA Q07869 1/20 0.46
SMPD1 P17405 5/20 0.44
RARA P10276 3/20 0.44
RARB P10826 2/20 0.44
RARG P13631 2/20 0.44
MEN1 O00255 1/20 0.44
NR1I2 O75469 1/20 0.44
LMNA P02545 1/20 0.44
PGR P06401 1/20 0.44
HSPD1 P10809 1/20 0.44
GOT1 P17174 1/20 0.44
GLRA1 P23415 1/20 0.44
BLM P54132 1/20 0.44
HSPE1 P61604 1/20 0.44
KMT2A Q03164 1/20 0.44
TDP1 Q9NUW8 1/20 0.44
FAAH O00519 1/20 0.42
CNR1 P21554 1/20 0.42

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
SCHEMBL8574873 1.00 PPARG (0.46) PPARGPPARDPPARASMPD1RARA
SCHEMBL8568116 1.00 PPARG (0.46) PPARGPPARDPPARASMPD1RARA
SCHEMBL8570912 1.00 PPARG (0.46) PPARGPPARDPPARASMPD1RARA
SCHEMBL8574242 0.93 RARA (0.47) PPARGPPARDPPARARARARARB
SCHEMBL8574326 0.92 RARA (0.44) PPARGPPARDPPARARARARARB
SCHEMBL8571354 0.91 RARA (0.43) PPARGPPARDPPARASMPD1RARA
SCHEMBL8614442 0.90 RARB (0.50) PPARGPPARDPPARARARARARB
SCHEMBL8618161 0.90 RARB (0.50) PPARGPPARDPPARARARARARB
SCHEMBL8615567 0.90 RARB (0.50) PPARGPPARDPPARARARARARB
SCHEMBL8615790 0.90 RARB (0.50) PPARGPPARDPPARARARARARB

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
US-5798354-A COSMETIC, THERAPY CENTRE INTERNATIONAL DE RECHERCHES DERMATOLOGIQUES GALDERMA (FR) 1998-08-25 US 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