SCHEMBL9979131

SCHEMBL9979131

O=C(CC(C(=O)Nc1ccc(F)cc1)C(CC(=O)Nc1ccc(F)cc1)C(=O)Nc1ccc(F)cc1)Nc1ccc(F)cc1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 3/20 0.56
ALDH1A1 P00352 3/20 0.53
LMNA P02545 2/20 0.52
KMT2A Q03164 4/20 0.52
MEN1 O00255 3/20 0.52
CYP1A2 P05177 2/20 0.52
CYP2C9 P11712 2/20 0.52
CYP2C19 P33261 2/20 0.52
HTT P42858 2/20 0.52
CYP3A4 P08684 1/20 0.52
CYP2D6 P10635 1/20 0.52
CRHBP P24387 1/20 0.52
CRHR2 Q13324 1/20 0.52
NPSR1 Q6W5P4 1/20 0.52
FNTA P49354 1/20 0.51
FNTB P49356 1/20 0.51
HDAC3 O15379 2/20 0.50
HDAC1 Q13547 2/20 0.50
HDAC2 Q92769 2/20 0.50
HDAC6 Q9UBN7 2/20 0.50

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
SCHEMBL9978869 0.86 GAA (0.56) GAAALDH1A1LMNAKMT2AMEN1
SCHEMBL6062563 0.83 LMNA (0.59) GAAALDH1A1LMNAKMT2AMEN1
SCHEMBL9979382 0.82 POLB (0.63) ALDH1A1LMNAFNTAFNTBHDAC3
SCHEMBL12197967 0.80 PTPN1 (0.73) GAAALDH1A1LMNAKMT2AMEN1
SCHEMBL9979379 0.79 CRHBP (0.57) ALDH1A1LMNAKMT2AMEN1CRHBP
SCHEMBL9979420 0.79 SMN1; SMN2 (0.59) GAAALDH1A1LMNAKMT2AMEN1
SCHEMBL6794740 0.79 GAA (0.66) GAAALDH1A1KMT2AMEN1HDAC3
Hydrochloric Acid SCHEMBL5794225 0.79 PTPN1 (0.71) GAAALDH1A1LMNAKMT2AMEN1
SCHEMBL1753925 0.78 GAA (0.70) GAAALDH1A1KMT2AMEN1HDAC3
SCHEMBL9979291 0.78 NPC1 (0.49) LMNAKMT2AMEN1HTTHDAC3

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