SCHEMBL9979154

SCHEMBL9979154

Cc1cc(C)cc(NC(=O)CC(C(=O)Nc2cc(C)cc(C)c2)C(CC(=O)Nc2cc(C)cc(C)c2)C(=O)Nc2cc(C)cc(C)c2)c1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTT P42858 1/20 0.59
NPSR1 Q6W5P4 1/20 0.59
CYP1A2 P05177 1/20 0.51
CYP3A4 P08684 1/20 0.51
HDAC3 O15379 1/20 0.51
HDAC4 P56524 1/20 0.51
HDAC1 Q13547 1/20 0.51
HDAC7 Q8WUI4 1/20 0.51
HDAC2 Q92769 1/20 0.51
HDAC10 Q969S8 1/20 0.51
HDAC11 Q96DB2 1/20 0.51
HDAC8 Q9BY41 1/20 0.51
HDAC6 Q9UBN7 1/20 0.51
HDAC9 Q9UKV0 1/20 0.51
HDAC5 Q9UQL6 1/20 0.51
TDP1 Q9NUW8 1/20 0.51
KMT2A Q03164 6/20 0.46
MEN1 O00255 4/20 0.46
L3MBTL1 Q9Y468 1/20 0.45
ATM Q13315 1/20 0.43

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
SCHEMBL9979140 0.86 HTT (0.69) HTTNPSR1CYP1A2CYP3A4HDAC3
SCHEMBL9979197 0.83 HPGD (0.59) CYP1A2CYP3A4HDAC3HDAC4HDAC1
SCHEMBL9979382 0.82 POLB (0.63) HDAC3HDAC4HDAC1HDAC7HDAC2
SCHEMBL8927824 0.79 CYP1A2 (0.59) HTTNPSR1CYP1A2CYP3A4HDAC3
SCHEMBL9979253 0.78 POLB (0.67) NPSR1CYP1A2CYP3A4HDAC3HDAC4
SCHEMBL9979097 0.77 LMNA (0.57) NPSR1KMT2AMEN1L3MBTL1MAPT
SCHEMBL6062563 0.76 LMNA (0.59) HTTKMT2AMEN1L3MBTL1ATM
SCHEMBL14254840 0.75 NPSR1 (0.63) HTTNPSR1CYP1A2CYP3A4HDAC3
SCHEMBL12240557 0.75 CYP3A4 (0.59) HTTNPSR1CYP1A2CYP3A4HDAC3
SCHEMBL9978854 0.75 TACR1 (0.67) MAPTLMNATHRB

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-8492468-B2 Polypropylene resin composition SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2013-07-23 US disclosed
US-20110301268-A1 POLYPROPYLENE RESIN COMPOSITION SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2011-12-08 US disclosed