SCHEMBL8460446

SCHEMBL8460446

CCOC(=O)c1ccc(C=Cc2ccc(OCC=C(C)C)cc2C)cc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAOB P27338 4/20 0.47
MEN1 O00255 1/20 0.44
NR1I2 O75469 1/20 0.44
LMNA P02545 1/20 0.44
PGR P06401 1/20 0.44
ADRB2 P07550 1/20 0.44
ADRB1 P08588 1/20 0.44
ADORA3 P0DMS8 1/20 0.44
MAPT P10636 1/20 0.44
HPGD P15428 1/20 0.44
CNR1 P21554 1/20 0.44
TBXA2R P21731 1/20 0.44
SLC6A2 P23975 1/20 0.44
AGTR1 P30556 1/20 0.44
ADRA1A P35348 1/20 0.44
OPRD1 P41143 1/20 0.44
OPRK1 P41145 1/20 0.44
BLM P54132 1/20 0.44
SLC6A3 Q01959 1/20 0.44
KMT2A Q03164 1/20 0.44

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
SCHEMBL8460443 1.00 MAOB (0.47) MAOBMEN1NR1I2LMNAPGR
SCHEMBL8458464 0.88 PPARG (0.49) MAOBMEN1NR1I2LMNAPGR
SCHEMBL8458466 0.88 PPARG (0.49) MAOBMEN1NR1I2LMNAPGR
SCHEMBL384028 0.82 CA12 (0.53) MEN1LMNAMAPTKMT2ATDP1
SCHEMBL8462156 0.79 RAB9A (0.40) MEN1LMNAHPGDKMT2APPARG
SCHEMBL8462153 0.79 RAB9A (0.40) MEN1LMNAHPGDKMT2APPARG
SCHEMBL9245384 0.78 HPGD (0.45) MAOBMEN1LMNAMAPTHPGD
SCHEMBL9240945 0.78 HPGD (0.45) MAOBMEN1LMNAMAPTHPGD
SCHEMBL9799811 0.78 HPGD (0.45) MAOBMEN1LMNAMAPTHPGD
SCHEMBL16687962 0.76 CA12 (0.56) MEN1LMNAHPGDKMT2ATDP1

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
WO-1999048529-A1 RETINOID-GLITAZONE COMBINATIONS WARNER-LAMBERT COMPANY (US) 1999-09-30 WO disclosed
EP-0808159-A1 USE OR RETINOIDS TO LOWER PLASMA LEVELS OF LIPOPROTEIN (a) WARNER-LAMBERT COMPANY (US) 1997-11-26 EP disclosed
WO-1996024344-A1 USE OF RETINOIDS TO LOWER PLASMA LEVELS OF LIPOPROTEIN (a) WARNER-LAMBERT COMPANY (US) 1996-08-15 WO disclosed
US-5489611-A ADMINISTERING A RETINOID COMPOUND WARNER-LAMBERT COMPANY (US) 1996-02-06 US disclosed