SCHEMBL8692189

SCHEMBL8692189

Cc1c(-c2ccccc2)c2cccnc2n(C)c1=O

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FEN1 P39748 2/20 0.49
KCNA3 P22001 3/20 0.47
ALDH1A1 P00352 1/20 0.45
TSHR P16473 1/20 0.45
CYP2C19 P33261 1/20 0.45
PDE4A P27815 1/20 0.44
PDE4B Q07343 1/20 0.44
PDE4C Q08493 1/20 0.44
PDE4D Q08499 1/20 0.44
EGFR P00533 1/20 0.42
SRC P12931 1/20 0.42
KMT2A Q03164 2/20 0.42
LMNA P02545 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
MEN1 O00255 1/20 0.42
KDM4E B2RXH2 1/20 0.42
SLC11A2 P49281 1/20 0.42
GRM4 Q14833 2/20 0.41
PADI4 Q9UM07 1/20 0.41
TNKS O95271 1/20 0.40

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
SCHEMBL2287924 0.78 FEN1 (0.43) FEN1ALDH1A1TSHRCYP2C19PDE4A
SCHEMBL18088031 0.78 KCNA3 (0.46) KCNA3TSHRKMT2ALMNASMN1; SMN2
SCHEMBL15432334 0.77 FEN1 (0.53) FEN1ALDH1A1CYP2C19PDE4APDE4B
SCHEMBL13402676 0.77 FEN1 (0.56) FEN1ALDH1A1CYP2C19PDE4DEGFR
SCHEMBL18074146 0.76 KCNA3 (0.44) KCNA3ALDH1A1KMT2ALMNASMN1; SMN2
SCHEMBL13787017 0.75 CYP11B2 (0.51) FEN1ALDH1A1TSHRCYP2C19EGFR
SCHEMBL13377295 0.73 FEN1 (0.49) FEN1ALDH1A1CYP2C19PDE4APDE4B
SCHEMBL8696587 0.72 HSD17B10 (0.60) FEN1KCNA3ALDH1A1TSHRCYP2C19
SCHEMBL18073980 0.71 KCNA3 (0.46) KCNA3ALDH1A1KMT2ALMNASMN1; SMN2
SCHEMBL6636299 0.71 PADI4 (0.47) FEN1ALDH1A1KMT2ALMNAKDM4E

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-5817670-A RESPIRATORY SYSTEM DISORDERS, ORGAN TRANSPLANTATION, ANTITUMOR AGENTS YAMANOUCHI PHARMACEUTICAL CO., LTD. (JP) 1998-10-06 US disclosed
EP-0779292-A1 NOVEL NAPHTHYRIDINE DERIVATIVE AND MEDICINAL COMPOSITION THEREOF YAMANOUCHI PHARMACEUTICAL CO. LTD. (JP) 1997-06-18 EP disclosed