SCHEMBL467294

SCHEMBL467294

C=CCc1c(Cc2ccccc2)c(C(=O)O)cc(C(=O)O)c1C(=O)O

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HNF4A P41235 1/20 0.44
ACMSD Q8TDX5 1/20 0.40
PTPN1 P18031 4/20 0.39
PTPN2 P17706 1/20 0.39
PTPN6 P29350 1/20 0.39
MAPT P10636 2/20 0.39
ALDH1A1 P00352 2/20 0.39
MEN1 O00255 1/20 0.39
LMNA P02545 1/20 0.39
GAA P10253 1/20 0.39
KMT2A Q03164 1/20 0.39
RXRA P19793 1/20 0.36
KLKB1 P03952 1/20 0.35
CTSB P07858 1/20 0.35
MMP9 P14780 1/20 0.35
DNMT1 P26358 1/20 0.35
DNMT3B Q9UBC3 1/20 0.35
DNMT3L Q9UJW3 1/20 0.35
DNMT3A Q9Y6K1 1/20 0.35
TSHR P16473 1/20 0.35

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
SCHEMBL4591557 0.80 PTPN1 (0.42) HNF4AACMSDPTPN1PTPN2PTPN6
SCHEMBL251906 0.80 TSHR (0.41) HNF4AACMSDPTPN1PTPN2PTPN6
SCHEMBL16246768 0.78 GAA (0.41) MAPTALDH1A1GAAKMT2ARXRA
SCHEMBL11236463 0.75 GPR35 (0.54) MAPTALDH1A1MEN1LMNAKMT2A
SCHEMBL301498 0.75 GAA (0.38) MAPTALDH1A1MEN1LMNAGAA
SCHEMBL28157114 0.74 KDM4E (0.37) MAPTALDH1A1GAARXRATSHR
SCHEMBL7147469 0.73 HNF4A (0.40) HNF4AACMSDPTPN1PTPN2PTPN6
SCHEMBL10706688 0.73 TSHR (0.40) ALDH1A1GAAKMT2ARXRAKLKB1
SCHEMBL29921822 0.73 HNF4A (0.51) HNF4AACMSDPTPN1PTPN2PTPN6
SCHEMBL15013239 0.72 GAA (0.38) MAPTALDH1A1MEN1LMNAGAA

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
EP-2404962-B1 Softener preparations with good gelling characteristics LANXESS DEUTSCHLAND GMBH (DE) 2013-01-16 EP disclosed
EP-2404962-A1 Softener preparations with good gelling characteristics LANXESS Deutschland GmbH (DE) 2012-01-11 EP disclosed