SCHEMBL9874859

SCHEMBL9874859

CCc1c(O)ccc(C(=O)O)c1O

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SELL P14151 1/20 0.57
SELP P16109 1/20 0.57
CSNK2A1 P68400 1/20 0.47
MEN1 O00255 2/20 0.46
KDR P35968 2/20 0.46
KMT2A Q03164 2/20 0.46
PDE4A P27815 1/20 0.46
BLVRB P30043 1/20 0.46
HTT P42858 1/20 0.46
KLKB1 P03952 1/20 0.46
CTSB P07858 1/20 0.46
MMP9 P14780 1/20 0.46
DNMT1 P26358 1/20 0.46
DNMT3B Q9UBC3 1/20 0.46
DNMT3L Q9UJW3 1/20 0.46
DNMT3A Q9Y6K1 1/20 0.46
ALDH1A1 P00352 4/20 0.45
CA1 P00915 3/20 0.45
CA2 P00918 3/20 0.45
CA12 O43570 2/20 0.45

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
SCHEMBL31336021 1.00 SELL (0.57) SELLSELPCSNK2A1MEN1KDR
SCHEMBL8374984 0.88 SELL (0.50) SELLSELPALDH1A1CA1CA2
SCHEMBL542401 0.86 SELL (0.48) SELLSELPCSNK2A1MEN1KDR
SCHEMBL31668786 0.86 SELL (0.48) SELLSELPCSNK2A1MEN1KDR
SCHEMBL10726758 0.85 SELL (0.53) SELLSELPCSNK2A1ALDH1A1MCL1
SCHEMBL6683046 0.84 SELL (0.47) SELLSELPALDH1A1KDM4EHPGD
SCHEMBL39790 0.84 SELL (0.57) SELLSELPCSNK2A1MEN1KDR
SCHEMBL2009246 0.84 ALDH1A1 (0.53) MEN1KMT2AHTTALDH1A1MCL1
SCHEMBL10897480 0.83 SELL (0.47) SELLSELPMEN1KMT2AHTT
SCHEMBL2581660 0.82 KDM4E (0.50) SELLSELPCSNK2A1KMT2AALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-103622842-A Delivery particles PROCTER & GAMBLE 2014-03-12 CN disclosed
CN-102883803-A Delivery particles PROCTER & GAMBLE 2013-01-16 CN disclosed
US-4999408-A Fireproofing GENERAL ELECTRIC COMPANY (US) 1991-03-12 US disclosed
EP-0372308-A2 Polycarbonate cross-linker resin and fire resistant compositions made therefrom GENERAL ELECTRIC COMPANY (US) 1990-06-13 EP disclosed
US-4927914-A NONDRIPPING GENERAL ELECTRIC COMPANY (US) 1990-05-22 US disclosed