SCHEMBL7978863

SCHEMBL7978863

CCOC(=O)c1ccccc1-c1ccc2ncnc(Nc3ccc4[nH]ccc4c3)c2c1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EGFR P00533 9/20 0.54
PIK3CA P42336 1/20 0.53
PIK3CG P48736 1/20 0.53
ERBB2 P04626 1/20 0.53
HPGD P15428 2/20 0.49
ALDH1A1 P00352 2/20 0.49
KDM4E B2RXH2 1/20 0.49
FLT1 P17948 4/20 0.48
LMNA P02545 2/20 0.48
POLB P06746 1/20 0.48
MAPT P10636 1/20 0.48
SMN1; SMN2 Q16637 1/20 0.48
RAB9A P51151 1/20 0.48
KDR P35968 4/20 0.45
USP2 O75604 1/20 0.44
CYP1A2 P05177 1/20 0.44
CYP3A4 P08684 1/20 0.44
CYP2D6 P10635 1/20 0.44
CYP2C9 P11712 1/20 0.44
TSHR P16473 1/20 0.44

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
SCHEMBL7976817 0.86 HPGD (0.62) EGFRPIK3CAPIK3CGERBB2HPGD
SCHEMBL7980026 0.86 EGFR (0.63) EGFRERBB2KDR
SCHEMBL7980190 0.80 EGFR (0.60) EGFRERBB2HPGDALDH1A1FLT1
SCHEMBL7979940 0.79 EGFR (0.64) EGFRERBB2HPGDALDH1A1KDM4E
SCHEMBL7983292 0.77 EGFR (0.67) EGFRPIK3CAPIK3CGFLT1KDR
SCHEMBL7125492 0.76 EGFR (0.70) EGFRERBB2FLT1
SCHEMBL7125487 0.76 EGFR (0.70) EGFRERBB2FLT1
SCHEMBL4367861 0.74 CLK4 (0.55) HPGDALDH1A1LMNAUSP2CYP1A2
SCHEMBL3606262 0.73 EGFR (0.73) EGFRPIK3CAPIK3CGERBB2FLT1
SCHEMBL7980576 0.73 EGFR (0.66) EGFRPIK3CAPIK3CGERBB2FLT1

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