SCHEMBL819613

SCHEMBL819613

COC(=O)C1=CCCCC=C1C(=O)OC

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CHRM3 P20309 2/20 0.42
LMNA P02545 3/20 0.41
CHRM2 P08172 1/20 0.41
CHRM4 P08173 1/20 0.41
CHRM5 P08912 1/20 0.41
THRB P10828 1/20 0.41
CHRM1 P11229 1/20 0.41
BLM P54132 1/20 0.40
MCOLN3 Q8TDD5 1/20 0.40
HDAC4 P56524 2/20 0.39
HDAC2 Q92769 2/20 0.39
HDAC8 Q9BY41 2/20 0.39
HDAC6 Q9UBN7 2/20 0.39
HDAC3 O15379 1/20 0.39
HDAC1 Q13547 1/20 0.39
HDAC7 Q8WUI4 1/20 0.39
HDAC5 Q9UQL6 1/20 0.39
TSHR P16473 2/20 0.38
NPSR1 Q6W5P4 1/20 0.37
SLC6A3 Q01959 3/20 0.37

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
SCHEMBL10937960 0.90 CHRM3 (0.45) CHRM3LMNACHRM2CHRM4CHRM5
SCHEMBL6575838 0.81 HDAC4 (0.41) CHRM3LMNACHRM2CHRM4CHRM5
SCHEMBL17049960 0.77 CHRM3 (0.40) CHRM3LMNACHRM2CHRM4CHRM5
SCHEMBL819891 0.76 TSHR (0.45) LMNATSHRCA1CA2CA12
SCHEMBL8569125 0.76 PTPN1 (0.41) CHRM3LMNACHRM2CHRM4CHRM5
SCHEMBL818926 0.76 CA12 (0.42) LMNATSHRSLC6A3CA1CA2
SCHEMBL16938801 0.76 CHRM3 (0.39) CHRM3LMNACHRM2CHRM4CHRM5
SCHEMBL819397 0.74 CHRM3 (0.35) CHRM3LMNACHRM2CHRM4CHRM5
SCHEMBL44118 0.73
SCHEMBL817598 0.73 NPC1 (0.38) CHRM3LMNACHRM2CHRM4CHRM5

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-8236908-B2 Components and catalysts for the polymerization of olefins SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2012-08-07 US disclosed
US-20110269927-A1 COMPONENTS AND CATALYSTS FOR THE POLYMERIZATION OF OLEFINS SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2011-11-03 US disclosed