SCHEMBL7486261

SCHEMBL7486261

NC(c1ccccc1)c1ncnc2ccccc12

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PI4KA P42356 1/20 0.48
PI4K2B Q8TCG2 1/20 0.48
PI4K2A Q9BTU6 1/20 0.48
PI4KB Q9UBF8 1/20 0.48
GALR3 O60755 3/20 0.47
NR2F2 P24468 3/20 0.47
ADORA2A P29274 3/20 0.46
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 4/20 0.42
DAPK3 O43293 1/20 0.42
MAP4K4 O95819 1/20 0.42
ABL1 P00519 1/20 0.42
ERBB2 P04626 1/20 0.42
PIM1 P11309 1/20 0.42
PRKACA P17612 1/20 0.42
LTK P29376 1/20 0.42
MAPK8 P45983 1/20 0.42

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
SCHEMBL2259231 0.77 L3MBTL1 (0.57) EGFRMAP4K4ABCG2HTTL3MBTL1
SCHEMBL6371765 0.75 PI4KA (0.52) PI4KAPI4K2BPI4K2API4KBGALR3
SCHEMBL3113119 0.74 MAOA (0.42) ADORA2AEGFRHTTRAB9ATSHR
SCHEMBL7381646 0.71 LMNA (0.65) RAB9ATSHRNPC1L3MBTL1ALDH1A1
SCHEMBL7486790 0.71 NCF1 (0.48) GALR3NR2F2ADORA2ARAB9ANPC1
SCHEMBL17875280 0.69 KDM4E (0.47) ADORA2AHTTALDH1A1LMNAHIF1A
SCHEMBL28542705 0.68 PDE4A (0.49) PI4KAPI4K2BPI4K2API4KBGALR3
SCHEMBL20115779 0.68 PI4KA (0.44) PI4KAPI4K2BPI4K2API4KBGALR3
SCHEMBL3106594 0.67 MAPT (0.42) HTTRAB9ATSHRNPC1L3MBTL1
4-Aminoquinazoline SCHEMBL142513 0.66 PI4KA (1.00) PI4KAPI4K2BPI4K2API4KBADORA2A

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-0860433-B1 QUINOLINE DERIVATIVES AND QUINAZOLINE DERIVATIVES INHIBITING AUTOPHOSPHORYLATION OF GROWTH FACTOR RECEPTOR ORIGINATING IN PLATELET AND PHARMACEUTICAL COMPOSITIONS CONTAINING THE SAME KIRIN BREWERY (JP) 2002-07-03 EP disclosed
US-6143764-A ETHER DERIVATIVES OF QUINOLINE, ANTITUMOR AGENTS KIRIN BEER KABUSHIKI KAISHA (JP) 2000-11-07 US disclosed
EP-0860433-A1 QUINOLINE DERIVATIVES AND QUINAZOLINE DERIVATIVES INHIBITING AUTOPHOSPHORYLATION OF GROWTH FACTOR RECEPTOR ORIGINATING IN PLATELET AND PHARMACEUTICAL COMPOSITIONS CONTAINING THE SAME KIRIN BEER KABUSHIKI KAISHA (JP) 1998-08-26 EP disclosed