SCHEMBL7976753

SCHEMBL7976753

c1cncc(-c2ccc3ncnc(Nc4ccc5[nH]ccc5c4)c3c2)c1

nearest known ligand 0.66

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 6/20 0.66
CYP3A4 P08684 6/20 0.66
LMNA P02545 4/20 0.66
HIF1A Q16665 4/20 0.66
MAPK1 P28482 3/20 0.66
RAF1 P04049 1/20 0.66
EGFR P00533 8/20 0.65
PIK3CA P42336 1/20 0.60
PIK3CG P48736 1/20 0.60
FLT1 P17948 3/20 0.53
KDR P35968 1/20 0.53
CLK4 Q9HAZ1 5/20 0.53
HSD17B10 Q99714 4/20 0.53
ALDH1A1 P00352 3/20 0.53
CYP2D6 P10635 3/20 0.53
CYP2C19 P33261 3/20 0.53
MEN1 O00255 2/20 0.53
KMT2A Q03164 2/20 0.53
KDM4E B2RXH2 2/20 0.53
HPGD P15428 2/20 0.53

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
SCHEMBL7966576 0.86 EGFR (0.57) CYP1A2CYP3A4LMNAHIF1AMAPK1
SCHEMBL7983292 0.83 EGFR (0.67) EGFRPIK3CAPIK3CGFLT1KDR
SCHEMBL27545981 0.82 EGFR (0.69) EGFRPIK3CAPIK3CGFLT1KDR
SCHEMBL7978607 0.82 EGFR (0.60) RAF1EGFRFLT1KDRERBB2
Hydrochloric Acid SCHEMBL7539353 0.82 EGFR (0.67) EGFRPIK3CAPIK3CGFLT1KDR
SCHEMBL7124447 0.81 FLT1 (0.81) EGFRFLT1KDR
SCHEMBL7980576 0.80 EGFR (0.66) EGFRPIK3CAPIK3CGFLT1KDR
SCHEMBL7535216 0.80 EGFR (0.65) EGFRPIK3CAPIK3CGFLT1KDR
SCHEMBL8093519 0.79 EGFR (1.00) EGFRPIK3CAPIK3CGFLT1ERBB2
SCHEMBL3606262 0.79 EGFR (0.73) EGFRPIK3CAPIK3CGFLT1KDR

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-0837063-A1 4-Aminoquinazoline derivatives PFIZER INC. (US) 1998-04-22 EP claimed
US-6225318-B1 4-aminoquinazolone derivatives PFIZER INC 2001-05-01 US disclosed
EP-0837063-A1 4-Aminoquinazoline derivatives PFIZER INC. (US) 1998-04-22 EP disclosed