SCHEMBL8501205

SCHEMBL8501205

CCC(=O)Oc1ccc2ncc(-c3cccc(F)c3)cc2c1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDGFRB P09619 4/20 0.51
PDGFRA P16234 4/20 0.51
MAPT P10636 2/20 0.48
KMT2A Q03164 2/20 0.48
NPC1 O15118 1/20 0.48
NFKB1 P19838 1/20 0.48
RAB9A P51151 1/20 0.48
NFKB2 Q00653 1/20 0.48
RELA Q04206 1/20 0.48
SMN1; SMN2 Q16637 1/20 0.48
MAOB P27338 1/20 0.44
GRIN2B Q13224 2/20 0.43
MAP4K4 O95819 1/20 0.43
CSNK1G2 P78368 1/20 0.43
CLK4 Q9HAZ1 1/20 0.43
MKNK2 Q9HBH9 1/20 0.43
MAP4K5 Q9Y4K4 1/20 0.43
DHODH Q02127 1/20 0.42
ALDH1A1 P00352 2/20 0.41
HPGD P15428 2/20 0.41

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
Hydrochloric Acid SCHEMBL8501620 0.90 MAOB (0.53) PDGFRBPDGFRAMAPTKMT2ANPC1
SCHEMBL8503241 0.81 KMT2A (0.50) PDGFRBPDGFRAMAPTKMT2ANPC1
SCHEMBL8501414 0.81 PDE3B (0.58) PDGFRBPDGFRA
SCHEMBL8499652 0.79 PPARG (0.54) PDGFRBPDGFRAMAOBGRIN2BMAP4K4
SCHEMBL8499648 0.79 PDE3B (0.55) PDGFRBPDGFRA
SCHEMBL8502489 0.78 PDGFRB (0.52) PDGFRBPDGFRAMAOBGRIN2BMAP4K4
SCHEMBL8887119 0.78 PDGFRB (0.47) PDGFRBPDGFRAGRIN2BMAP4K4CSNK1G2
SCHEMBL8502972 0.78 PDGFRB (0.46) PDGFRBPDGFRAMAPTKMT2ANPC1
SCHEMBL27616493 0.77 KMT2A (0.50) PDGFRBPDGFRAMAPTKMT2ANPC1
Hydrochloric Acid SCHEMBL8504144 0.77 PDGFRB (0.51) PDGFRBPDGFRAMAPTKMT2ASMN1; SMN2

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
US-RE36256-E ADMINISTERING ARYL-SUBSTITUTED QUINOXALINE DERIVATIVES AS ANTIPROLIFERATIVE, ANTICARCINOGENIC AND ANTITUMOR AGENTS RHONE-POULENC RORER PHARMACEUTICALS, INC. (US) 1999-07-20 US disclosed
US-5795889-A INHIBITING CELL GROWTH WITH ENZYME INHIBITORS FOR SKIN DISORDERS RHONE-POULENC RORER PHARMACEUTICALS INC. (US) 1998-08-18 US disclosed