SCHEMBL9979042

SCHEMBL9979042

Cc1cc(C(C)(C)C)ccc1NC(=O)CC(CC(=O)Nc1ccc(C(C)(C)C)cc1C)C(=O)Nc1ccc(C(C)(C)C)cc1C

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.46
KMT2A Q03164 2/20 0.46
NR1H4 Q96RI1 1/20 0.46
HTT P42858 2/20 0.43
ALDH1A1 P00352 2/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
SLC1A3 P43003 2/20 0.43
SLC1A2 P43004 2/20 0.43
SLC1A1 P43005 2/20 0.43
HDAC3 O15379 1/20 0.40
HDAC4 P56524 1/20 0.40
HDAC1 Q13547 1/20 0.40
HDAC7 Q8WUI4 1/20 0.40
HDAC2 Q92769 1/20 0.40
HDAC10 Q969S8 1/20 0.40
HDAC11 Q96DB2 1/20 0.40
HDAC8 Q9BY41 1/20 0.40
HDAC6 Q9UBN7 1/20 0.40
HDAC9 Q9UKV0 1/20 0.40
HDAC5 Q9UQL6 1/20 0.40

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
SCHEMBL9979041 0.89 MEN1 (0.46) MEN1KMT2ANR1H4HTTALDH1A1
SCHEMBL9979141 0.84 KMT2A (0.68) MEN1KMT2AHTTALDH1A1SMN1; SMN2
SCHEMBL9978964 0.81 ALDH1A1 (0.54) MEN1KMT2AHTTALDH1A1SMN1; SMN2
SCHEMBL9979157 0.80 MEN1 (0.46) MEN1KMT2AHTTALDH1A1SMN1; SMN2
SCHEMBL9979431 0.80 MEN1 (0.46) MEN1KMT2AHTTALDH1A1SMN1; SMN2
SCHEMBL6781081 0.79 MEN1 (0.51) MEN1KMT2ANR1H4HTTALDH1A1
SCHEMBL9978920 0.78 MEN1 (0.44) MEN1KMT2AHTTALDH1A1SMN1; SMN2
SCHEMBL9979122 0.78 MEN1 (0.44) MEN1KMT2AHTTALDH1A1SMN1; SMN2
SCHEMBL25111316 0.78 POLB (0.54) MEN1KMT2ANR1H4HTTALDH1A1
SCHEMBL9978909 0.77 HPGD (0.58) ALDH1A1SMN1; SMN2HDAC3HDAC4HDAC1

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