SCHEMBL9003595

SCHEMBL9003595

O=C(O)c1cc(CCc2ccc(OCCOc3ccccc3)cc2)ccc1O

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LCK P06239 2/20 0.60
MCL1 Q07820 2/20 0.56
HNF4A P41235 1/20 0.55
EGFR P00533 1/20 0.54
KLKB1 P03952 1/20 0.53
CTSB P07858 1/20 0.53
MMP9 P14780 1/20 0.53
DNMT1 P26358 1/20 0.53
DNMT3B Q9UBC3 1/20 0.53
DNMT3L Q9UJW3 1/20 0.53
DNMT3A Q9Y6K1 1/20 0.53
PKM P14618 1/20 0.51
ALDH1A1 P00352 1/20 0.51
KAT8 Q9H7Z6 2/20 0.50
FFAR1 O14842 4/20 0.49
MEN1 O00255 1/20 0.47
KMT2A Q03164 1/20 0.47
APP P05067 1/20 0.47
PTPRC P08575 1/20 0.46
PTPN2 P17706 1/20 0.46

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
SCHEMBL9003351 0.94 KAT8 (0.55) LCKMCL1HNF4AEGFRKLKB1
SCHEMBL9003322 0.93 KAT8 (0.60) LCKMCL1HNF4AEGFRKLKB1
SCHEMBL9003598 0.93 KAT8 (0.60) LCKMCL1HNF4AEGFRKLKB1
SCHEMBL9003186 0.93 KAT8 (0.60) LCKMCL1HNF4AEGFRKLKB1
SCHEMBL9003398 0.89 LCK (0.57) LCKMCL1HNF4AEGFRKLKB1
SCHEMBL9003403 0.89 HNF4A (0.72) LCKMCL1HNF4AKLKB1CTSB
SCHEMBL9303557 0.86 PKM (0.59) MCL1HNF4APKMALDH1A1PTPN11
SCHEMBL29178595 0.85 LCK (0.77) LCKMCL1HNF4AEGFRKLKB1
SCHEMBL9003415 0.84 LCK (0.49) LCKMCL1HNF4AEGFRKLKB1
SCHEMBL9304341 0.84 KAT8 (0.71) LCKMCL1KAT8PTPN11

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0424914-B1 Recording material NEW OJI PAPER CO LTD (JP) 1996-09-25 EP disclosed
US-5276001-A Color developer comprising salicylic acid derivative KANZAKI PAPER MANUFACTURING CO., LTD. (JP) 1994-01-04 US disclosed
US-5096872-A Colorless basic dye reacts with salicylic acid derivative to form colored image, paper KANZAKI PAPER MANUFACTURING CO., LTD. (JP) 1992-03-17 US disclosed
EP-0424914-A2 Recording material NEW OJI PAPER CO., LTD. (JP) 1991-05-02 EP disclosed