SCHEMBL7845374

SCHEMBL7845374

[CH2]Cc1ccc(C(=O)O)c(C(=O)O)c1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KLKB1 P03952 1/20 0.48
CTSB P07858 1/20 0.48
MMP9 P14780 1/20 0.48
DNMT1 P26358 1/20 0.48
DNMT3B Q9UBC3 1/20 0.48
DNMT3L Q9UJW3 1/20 0.48
DNMT3A Q9Y6K1 1/20 0.48
ALDH1A1 P00352 4/20 0.47
CDC25B P30305 2/20 0.47
CASP6 P55212 1/20 0.47
RCE1 Q9Y256 1/20 0.47
LCK P06239 1/20 0.44
HNF4A P41235 1/20 0.43
HSD17B10 Q99714 2/20 0.42
CDC25A P30304 1/20 0.42
ALOX15 P16050 1/20 0.42
CYP1A2 P05177 1/20 0.42
TDP1 Q9NUW8 2/20 0.41
MEN1 O00255 1/20 0.41
CYP2D6 P10635 1/20 0.41

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
SCHEMBL7853231 0.83 LCK (0.50) KLKB1CTSBMMP9DNMT1DNMT3B
Ethylene SCHEMBL28295970 0.83 KLKB1 (0.64) KLKB1CTSBMMP9DNMT1DNMT3B
SCHEMBL29404777 0.82 LCK (0.62) KLKB1CTSBMMP9DNMT1DNMT3B
SCHEMBL29365057 0.82 KLKB1 (0.69) KLKB1CTSBMMP9DNMT1DNMT3B
SCHEMBL21621 0.82 KLKB1 (0.69) KLKB1CTSBMMP9DNMT1DNMT3B
SCHEMBL23103 0.82 LCK (0.62) KLKB1CTSBMMP9DNMT1DNMT3B
SCHEMBL7965223 0.82 NR1H4 (0.50) KLKB1CTSBMMP9DNMT1DNMT3B
SCHEMBL19748200 0.82 HMGB1 (0.46) KLKB1CTSBMMP9DNMT1DNMT3B
SCHEMBL7853570 0.80 KAT8 (0.49) KLKB1CTSBMMP9DNMT1DNMT3B
SCHEMBL5553313 0.80 KLKB1 (0.67) KLKB1CTSBMMP9DNMT1DNMT3B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1084330-C Cydic amide derivatives OTSUKA PHARMA CO LTD (JP) 2002-05-08 CN disclosed
EP-0719258-B1 CYCLIC AMIDE DERIVATIVES FOR PROTECTING AGAINST ULTRAVIOLET RAYS OTSUKA PHARMA CO LTD (JP) 2001-10-31 EP disclosed
US-5786367-A OXYGEN SCAVENGERS OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1998-07-28 US disclosed
CN-1130377-A Cyclic amide derivatives OTSUKA PHARMA CO LTD (JP) 1996-09-04 CN disclosed
EP-0719258-A1 CYCLIC AMIDE DERIVATIVES FOR PROTECTING AGAINST ULTRAVIOLET RAYS OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1996-07-03 EP disclosed
WO-1996002508-A1 CYCLIC AMIDE DERIVATIVES FOR PROTECTING AGAINST ULTRAVIOLET RAYS OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1996-02-01 WO disclosed