SCHEMBL5655010

SCHEMBL5655010

CC(ON1C(C)(C)CC(O)CC1(C)C)c1ccc(O)cc1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ESR1 P03372 3/20 0.36
ESR2 Q92731 3/20 0.36
PDCD1 Q15116 1/20 0.36
CD274 Q9NZQ7 1/20 0.36
GRIN2B Q13224 9/20 0.35
KMT2A Q03164 1/20 0.34
GRIN1 Q05586 3/20 0.32
CYP2D6 P10635 2/20 0.32
GRIN2D O15399 2/20 0.32
KCNH2 Q12809 2/20 0.32
GRIN2A Q12879 2/20 0.32
GRIN2C Q14957 2/20 0.32
GRIN3B O60391 1/20 0.32
GRIN3A Q8TCU5 1/20 0.32
ADRA2A P08913 2/20 0.31
HTR2A P28223 2/20 0.31
ADRA1A P35348 2/20 0.31
SIGMAR1 Q99720 2/20 0.31
LMNA P02545 1/20 0.31
ADRB1 P08588 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
SCHEMBL6809943 0.86 KMT2A (0.37) KMT2ACYP2D6LMNAOPRK1
SCHEMBL9039578 0.81 ESR1 (0.38) ESR1ESR2PDCD1CD274GRIN2B
SCHEMBL14440852 0.78 MMP1 (0.41) KMT2ACYP2D6ADRB1RAB9A
SCHEMBL4801749 0.75 KMT2A (0.35) KMT2ACYP2D6LMNAOPRK1
SCHEMBL886985 0.75 KMT2A (0.35) KMT2ACYP2D6LMNAOPRK1
SCHEMBL976664 0.73 HSD11B1 (0.32) ESR1ESR2PDCD1CD274
SCHEMBL13008873 0.73 SLC6A2 (0.38) KMT2ACYP2D6KCNH2ADRA2AHTR2A
SCHEMBL2809617 0.73 GAA (0.31) KMT2A
SCHEMBL8853589 0.72 HPGD (0.31)
SCHEMBL13008720 0.71 TACR1 (0.39) KMT2ACYP2D6ADRA2ALMNAADRA2B

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-7253232-B2 Thermoplastic compositions with enhanced melt flow and compatibility CIBA SPECIALTY CHEMICALS CORP. (US) 2007-08-07 US disclosed
US-20050288435-A1 Thermoplastic compositions with enhanced melt flow and compatibility CIBA SPECIALTY CHEMICALS CORP. 2005-12-29 US disclosed
EP-1543077-A1 THERMOPLASTIC COMPOSITIONS WITH ENHANCED MELT FLOW AND COMPATIBILITY Ciba SC Holding AG (CH) 2005-06-22 EP disclosed
WO-2004029156-A1 THERMOPLASTIC COMPOSITIONS WITH ENHANCED MELT FLOW AND COMPATIBILITY CIBA SPECIALTY CHEMICALS HOLDING INC. (CH) 2004-04-08 WO disclosed