SCHEMBL13850899

SCHEMBL13850899

Cc1ccc(C(=O)O)c2cc(CO)nn12

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MYC P01106 13/20 0.42
CTSB P07858 2/20 0.42
KLKB1 P03952 1/20 0.42
ELANE P08246 1/20 0.42
MMP9 P14780 1/20 0.42
DUSP3 P51452 1/20 0.42
NR4A1 P22736 5/20 0.41
HAAO P46952 1/20 0.39
PKM P14618 1/20 0.39
PTPN1 P18031 1/20 0.39
TDP1 Q9NUW8 2/20 0.38
POLB P06746 2/20 0.37
MAPT P10636 2/20 0.37
MEN1 O00255 1/20 0.37
RECQL P46063 1/20 0.37
KMT2A Q03164 1/20 0.37
ESR2 Q92731 1/20 0.37
ALDH1A1 P00352 1/20 0.36
NOTUM Q6P988 1/20 0.36
PDE4B Q07343 1/20 0.36

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
SCHEMBL3222862 0.81 PDE4B (0.51) PDE4BPDE3A
SCHEMBL2968564 0.75 PDE4B (0.46) POLBKMT2AALDH1A1PDE4BPDE3A
SCHEMBL13851030 0.72 PDE4B (0.44) POLBMAPTMEN1KMT2AALDH1A1
SCHEMBL3460245 0.72 DHODH (0.41) MYCNR4A1TDP1POLBMAPT
SCHEMBL2960864 0.70 PDE4B (0.63) PDE4BPDE3A
SCHEMBL13851129 0.69 PDE4B (0.46) POLBMAPTPDE4BPDE3A
SCHEMBL3221313 0.69 PDE4B (0.64) PDE4BPDE3A
SCHEMBL3603220 0.65 GABRP (0.56) TDP1POLBMEN1KMT2AALDH1A1
SCHEMBL13851338 0.64 KDM4E (0.44) MYCNR4A1HAAOTDP1POLB
SCHEMBL3222485 0.64 DHODH (0.40) MYCNR4A1TDP1RECQLALDH1A1

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
EP-2060572-A1 PYRAZOLOPYRIDINE DERIVATIVE AND PHOSPHODIESTERASE (PDE) INHIBITOR CONTAINING THE SAME AS ACTIVE INGREDIENT Kyorin Pharmaceutical Co., Ltd. (JP) 2009-05-20 EP disclosed