SCHEMBL11654792

SCHEMBL11654792

COC(=O)c1cc(Cl)c(C(=O)O)c(C)c1Cl

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 1/20 0.44
KDM4E B2RXH2 4/20 0.40
MEN1 O00255 2/20 0.40
KMT2A Q03164 2/20 0.40
HSD17B10 Q99714 2/20 0.40
LMNA P02545 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
ABL1 P00519 2/20 0.39
ALDH1A1 P00352 1/20 0.39
HTT P42858 1/20 0.38
NR4A2 P43354 3/20 0.38
PTGS2 P35354 1/20 0.38
NQO2 P16083 1/20 0.37
POLB P06746 2/20 0.36
MAPT P10636 2/20 0.36
NPC1 O15118 1/20 0.36
PKM P14618 1/20 0.36
RECQL P46063 1/20 0.36
BLM P54132 1/20 0.36
BCL2L1 Q07817 1/20 0.36

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
SCHEMBL11231441 0.84 MYC (0.42) KDM4EMEN1KMT2AHSD17B10SMN1; SMN2
SCHEMBL8159962 0.79 GAA (0.49) GAAKDM4EMEN1KMT2ALMNA
SCHEMBL522450 0.79 GAA (0.49) GAAKDM4EMEN1KMT2AHSD17B10
SCHEMBL11231331 0.77 SMN1; SMN2 (0.42) GAAKDM4EMEN1KMT2AHSD17B10
SCHEMBL5713093 0.76 ALDH1A1 (0.44) KDM4EMEN1KMT2AHSD17B10LMNA
SCHEMBL10627038 0.75 GAA (0.53) GAAKDM4EHSD17B10ABL1ALDH1A1
SCHEMBL10628671 0.75 GAA (0.45) GAAMEN1KMT2ALMNASMN1; SMN2
SCHEMBL8467731 0.74 MYC (0.43) KDM4EMEN1KMT2AHSD17B10SMN1; SMN2
SCHEMBL7959177 0.74 ALDH1A1 (0.46) GAAKDM4EKMT2AHSD17B10SMN1; SMN2
SCHEMBL8331805 0.74 GAA (0.51) GAAKDM4EMEN1KMT2ALMNA

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-4101528-A FLAME RETARDANT AVTEX FIBERS INC. (US) 1978-07-18 US disclosed
US-4059546-A Textile fiber blend comprising cellulosic fibers and ethylene 2,6-naphthalene dicarboxylate-halogenated comonomers copolyester fibers AVTEX FIBERS INC. (US) 1977-11-22 US disclosed