SCHEMBL9303988

SCHEMBL9303988

O=C(O)c1cc(OCCCCOc2ccccc2)ccc1O

nearest known ligand 0.57

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
MCL1 Q07820 3/20 0.57
PTPN11 Q06124 2/20 0.55
PKM P14618 1/20 0.53
ALDH1A1 P00352 2/20 0.53
KCNA3 P22001 1/20 0.52
KDM4E B2RXH2 1/20 0.49
MAPT P10636 1/20 0.49
HNF4A P41235 3/20 0.49
ACMSD Q8TDX5 2/20 0.49
DHFR P00374 1/20 0.49
PLA2G4B P0C869 1/20 0.47

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
SCHEMBL9303557 0.95 PKM (0.59) MCL1PTPN11PKMALDH1A1KDM4E
SCHEMBL9304812 0.88 MCL1 (0.54) MCL1PTPN11PKMALDH1A1KDM4E
SCHEMBL8053343 0.87 PPARD (0.57) PTPN11PKMALDH1A1KCNA3
SCHEMBL312645 0.87 PTPN11 (0.57) PTPN11PKMALDH1A1KCNA3PLA2G4B
SCHEMBL29706508 0.87 PTPN11 (0.57) PTPN11PKMALDH1A1KCNA3PLA2G4B
SCHEMBL14770776 0.86 MCL1 (0.57) MCL1PTPN11HNF4APLA2G4B
SCHEMBL8053501 0.86 PPARD (0.56) PTPN11PKMALDH1A1
SCHEMBL8062685 0.86 PPARD (0.56) PTPN11PKMALDH1A1
SCHEMBL9285957 0.86 MCL1 (0.66) MCL1PTPN11PLA2G4B
SCHEMBL8064850 0.86 PPARD (0.56) PTPN11PKMALDH1A1

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5276001-A Color developer comprising salicylic acid derivative KANZAKI PAPER MANUFACTURING CO., LTD. (JP) 1994-01-04 US disclosed