SCHEMBL7983292

SCHEMBL7983292

c1ccc(-c2ccc3ncnc(Nc4ccc5[nH]ccc5c4)c3c2)nc1

nearest known ligand 0.67

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
EGFR P00533 13/20 0.67
PIK3CA P42336 1/20 0.59
PIK3CG P48736 1/20 0.59
FLT1 P17948 7/20 0.55
KDR P35968 2/20 0.55
ATM Q13315 1/20 0.53
PRKD1 Q15139 1/20 0.50
DYRK1A Q13627 2/20 0.49

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
SCHEMBL7976753 0.83 CYP1A2 (0.66) EGFRPIK3CAPIK3CGFLT1KDR
SCHEMBL3606262 0.83 EGFR (0.73) EGFRPIK3CAPIK3CGFLT1KDR
Hydrochloric Acid SCHEMBL8593958 0.82 EGFR (0.72) EGFRFLT1KDRPRKD1
SCHEMBL7976658 0.82 EGFR (0.62) EGFRPIK3CAPIK3CGFLT1KDR
SCHEMBL7976662 0.82 EGFR (0.62) EGFRPIK3CAPIK3CGFLT1KDR
SCHEMBL7966689 0.81 RET (0.62) EGFRKDRATM
SCHEMBL7966427 0.81 EGFR (0.61) EGFRPIK3CAPIK3CGFLT1KDR
SCHEMBL8093519 0.81 EGFR (1.00) EGFRPIK3CAPIK3CGFLT1
SCHEMBL7980576 0.80 EGFR (0.66) EGFRPIK3CAPIK3CGFLT1KDR
SCHEMBL1733829 0.80 EGFR (0.76) 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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