SCHEMBL9039014

SCHEMBL9039014

CCOC(=O)C=C1c2ccccc2NC(=O)c2ccncc21

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TGM2 P21980 2/20 0.48
ABL1 P00519 1/20 0.47
RET P07949 1/20 0.47
PDGFRB P09619 1/20 0.47
FGFR1 P11362 1/20 0.47
FLT3 P36888 1/20 0.47
ALK Q9UM73 1/20 0.47
IDO1 P14902 2/20 0.47
TDO2 P48775 1/20 0.47
KDR P35968 1/20 0.45
MAPT P10636 4/20 0.45
ALDH1A1 P00352 2/20 0.45
HTT P42858 2/20 0.45
LMNA P02545 1/20 0.45
SMN1; SMN2 Q16637 1/20 0.45
MAPK1 P28482 3/20 0.44
KDM4E B2RXH2 2/20 0.44
PKM P14618 1/20 0.44
NPSR1 Q6W5P4 1/20 0.44
CASP1 P29466 1/20 0.43

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
SCHEMBL9039009 1.00 TGM2 (0.48) TGM2ABL1RETPDGFRBFGFR1
SCHEMBL249816 0.83 ALDH1A1 (0.64) TGM2ABL1RETPDGFRBFGFR1
SCHEMBL249817 0.83 ALDH1A1 (0.64) TGM2ABL1RETPDGFRBFGFR1
SCHEMBL14524539 0.83 ALDH1A1 (0.64) TGM2ABL1RETPDGFRBFGFR1
SCHEMBL9041488 0.82 TGM2 (0.55) TGM2ALKIDO1MAPTALDH1A1
SCHEMBL9041481 0.82 TGM2 (0.55) TGM2ALKIDO1MAPTALDH1A1
SCHEMBL9041602 0.77 TGM2 (0.55) TGM2IDO1MAPTALDH1A1HTT
SCHEMBL9041594 0.77 TGM2 (0.55) TGM2IDO1MAPTALDH1A1HTT
SCHEMBL9041507 0.73 TGM2 (0.46) TGM2RETPDGFRBFGFR1FLT3
SCHEMBL9041503 0.73 TGM2 (0.46) TGM2RETPDGFRBFGFR1FLT3

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-0347831-B1 Pyridine derivatives and intermediates thereof KYOWA HAKKO KOGYO KK (JP) 1996-12-11 EP disclosed
US-4971964-A INHIBITORS OF THROMBOXANE SYNTHASE, CARDIOVASCULAR DISORDERS, ANTIINFLAMMATORU AGENTS, CANCER KYOWA HAKKO KOGYO CO., LTD. (JP) 1990-11-20 US disclosed