SCHEMBL15324928

SCHEMBL15324928

CCNc1c([N+](=O)[O-])cc(C(=O)OC)c2c1OCCO2

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDGFRB P09619 1/20 0.43
FGFR1 P11362 1/20 0.43
PDGFRA P16234 1/20 0.43
FLT1 P17948 1/20 0.43
FGFR3 P22607 1/20 0.43
KDR P35968 1/20 0.43
HTR4 Q13639 1/20 0.43
ALDH1A1 P00352 7/20 0.39
LMNA P02545 2/20 0.39
SIRT6 Q8N6T7 1/20 0.39
GALR2 O43603 1/20 0.38
MITF O75030 1/20 0.38
POLB P06746 1/20 0.38
HSP90AA1 P07900 1/20 0.38
HPGD P15428 1/20 0.38
XBP1 P17861 1/20 0.38
CCR6 P51684 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
NPSR1 Q6W5P4 1/20 0.38
KDM4E B2RXH2 1/20 0.38

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
SCHEMBL15322464 0.86 PDGFRB (0.43) PDGFRBFGFR1PDGFRAFLT1FGFR3
SCHEMBL7398875 0.81 HTR4 (0.55) PDGFRBFGFR1PDGFRAFLT1FGFR3
SCHEMBL13603006 0.81 PDGFRB (0.43) PDGFRBFGFR1PDGFRAFLT1FGFR3
SCHEMBL13385019 0.81 PDGFRB (0.43) PDGFRBFGFR1PDGFRAFLT1FGFR3
SCHEMBL15324655 0.81 KDM4E (0.50) HTR4ALDH1A1LMNAHPGDKDM4E
SCHEMBL13603024 0.76 PDGFRB (0.41) PDGFRBFGFR1PDGFRAFLT1FGFR3
SCHEMBL14249660 0.75 PDGFRB (0.43) PDGFRBFGFR1PDGFRAFLT1FGFR3
SCHEMBL14249239 0.72 SMN1; SMN2 (0.49) ALDH1A1LMNAPOLBSMN1; SMN2NPSR1
SCHEMBL666308 0.72 ALDH1A1 (0.62) PDGFRBFGFR1PDGFRAFLT1FGFR3
SCHEMBL30514054 0.72 ALDH1A1 (0.62) PDGFRBFGFR1PDGFRAFLT1FGFR3

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
WO-2013153535-A1 TRICYCLIC COMPOUNDS AS mPGES-1 INHIBITORS GLENMARK PHARMACEUTICALS S.A. (CH) 2013-10-17 WO disclosed
WO-2013153535-A1 TRICYCLIC COMPOUNDS AS mPGES-1 INHIBITORS GLENMARK PHARMACEUTICALS S.A. (CH) 2013-10-17 WO disclosed