SCHEMBL7018953

SCHEMBL7018953

CCCC1=C(C(=O)O)C(c2cccc(OC)c2OC)c2c[nH]nc2N1

nearest known ligand 0.41

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
GAA P10253 5/20 0.41
ALDH1A1 P00352 4/20 0.41
KDM4E B2RXH2 4/20 0.41
GLA P06280 1/20 0.41
HSD17B10 Q99714 6/20 0.39
HPGD P15428 2/20 0.39
CASP1 P29466 2/20 0.39
CASP7 P55210 1/20 0.39
BAP1 Q92560 1/20 0.39
PKM P14618 1/20 0.37
TSHR P16473 4/20 0.36
NPC1 O15118 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
PPARA Q07869 1/20 0.36
HTT P42858 2/20 0.36
MEN1 O00255 2/20 0.36
KMT2A Q03164 2/20 0.36
GSK3A P49840 1/20 0.35
GSK3B P49841 1/20 0.35

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
SCHEMBL7433747 0.91 ALDH1A1 (0.37) ALDH1A1KDM4EHSD17B10SMN1; SMN2PPARA
SCHEMBL6297388 0.89 PKM (0.47) GAAALDH1A1KDM4EGLAHSD17B10
SCHEMBL7148024 0.82 KDM4E (0.39) GAAALDH1A1KDM4EHSD17B10TSHR
SCHEMBL7017886 0.81 CACNA1D (0.31)
SCHEMBL7429502 0.81 CYP2C9 (0.42) GAAALDH1A1KDM4EHSD17B10HPGD
SCHEMBL7435806 0.81 MEN1 (0.39) ALDH1A1KDM4EHPGDPKMTSHR
SCHEMBL7441431 0.81 PYGL (0.39) GAAALDH1A1KDM4EGLAHSD17B10
SCHEMBL6296486 0.80 NR3C2 (0.40) GAAALDH1A1KDM4EHSD17B10HPGD
SCHEMBL6292394 0.80 DHFR (0.47) ALDH1A1KDM4EHPGDPKMTSHR
SCHEMBL7434003 0.79 CACNA1D (0.33) ALDH1A1HPGDSMN1; SMN2MEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1355909-A2 DIHYDROPYRAZOLOPYRIDINE COMPOUNDS AND PHARMACEUTICAL USE THEREOF Mitsubishi Pharma Corporation (JP) 2003-10-29 EP disclosed
WO-2002062795-A2 DIHYDROPYRAZOLOPYRIDINE COMPOUNDS AND PHARMACEUTICAL USE THEREOF MITSUBISHI PHARMA CORPORATION (JP) 2002-08-15 WO disclosed