SCHEMBL7148024

SCHEMBL7148024

CCCC1=C(C(=O)O)C(c2cc(OC)ccc2OC)c2c[nH]nc2N1

nearest known ligand 0.40

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 3/20 0.39
POLB P06746 3/20 0.39
HSD17B10 Q99714 2/20 0.39
TP53 P04637 1/20 0.39
PTGDR2 Q9Y5Y4 1/20 0.38
PLA2G4B P0C869 1/20 0.38
CYP3A4 P08684 1/20 0.37
CYP2C9 P11712 1/20 0.37
CYP2C19 P33261 1/20 0.37
TSHR P16473 1/20 0.37
MAPT P10636 2/20 0.37
SMN1; SMN2 Q16637 2/20 0.37
ALDH1A1 P00352 1/20 0.37
HIF1A Q16665 1/20 0.36
GAA P10253 1/20 0.35
BRDT Q58F21 1/20 0.35
MTNR1A P48039 1/20 0.35
MTNR1B P49286 1/20 0.35
ALPL P05186 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
SCHEMBL6293415 0.89 KDM4E (0.49) KDM4EPOLBHSD17B10TP53CYP3A4
SCHEMBL7433747 0.86 ALDH1A1 (0.37) KDM4EPOLBHSD17B10TP53CYP2C9
SCHEMBL7018953 0.82 GAA (0.41) KDM4EHSD17B10TSHRSMN1; SMN2ALDH1A1
SCHEMBL6292394 0.76 DHFR (0.47) KDM4EPOLBTP53CYP2C9CYP2C19
SCHEMBL7027096 0.75 TSHR (0.35) TSHR
SCHEMBL7020208 0.74 KDM4E (0.39) KDM4EALDH1A1
SCHEMBL7431137 0.71 ALOX15 (0.36) KDM4EPOLBHSD17B10TP53CYP3A4
SCHEMBL7433250 0.71 CACNA1C (0.41) KDM4EPOLBHSD17B10TP53PLA2G4B
SCHEMBL7021047 0.69 MGAM (0.31) GAA
SCHEMBL6296656 0.69 TBXA2R (0.46) KDM4EPOLBHSD17B10TP53CYP3A4

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 3 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-A9 DIHYDROPYRAZOLOPYRIDINE COMPOUNDS AND PHARMACEUTICAL USE THEREOF MITSUBISHI PHARMA CORP (JP) 2002-10-10 WO disclosed
WO-2002062795-A2 DIHYDROPYRAZOLOPYRIDINE COMPOUNDS AND PHARMACEUTICAL USE THEREOF MITSUBISHI PHARMA CORPORATION (JP) 2002-08-15 WO disclosed