SCHEMBL7976867

SCHEMBL7976867

C#Cc1cccc(Nc2ncnc3ccc(-c4ccccc4)cc23)c1

nearest known ligand 0.70

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EGFR P00533 8/20 0.70
ERBB2 P04626 2/20 0.70
ERBB4 Q15303 2/20 0.70
BRAF P15056 6/20 0.69
RAF1 P04049 6/20 0.69
GAK O14976 3/20 0.61
FBP1 P09467 2/20 0.61
ALDH1A1 P00352 2/20 0.61
MAPT P10636 1/20 0.61
LMNA P02545 5/20 0.60
CYP3A4 P08684 5/20 0.60
CYP1A2 P05177 4/20 0.60
MEN1 O00255 3/20 0.60
USP2 O75604 3/20 0.60
TSHR P16473 3/20 0.60
CYP2C19 P33261 3/20 0.60
KMT2A Q03164 3/20 0.60
CLK4 Q9HAZ1 3/20 0.60
MAPK1 P28482 2/20 0.60
CYP2C9 P11712 1/20 0.60

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
SCHEMBL7982859 0.91 EGFR (0.68) EGFRERBB2ERBB4BRAFRAF1
SCHEMBL7978774 0.91 EGFR (0.71) EGFRERBB2ERBB4BRAFRAF1
SCHEMBL7982823 0.89 EGFR (0.68) EGFRERBB2ERBB4BRAFRAF1
SCHEMBL15051921 0.88 BRAF (0.72) EGFRERBB2ERBB4BRAFRAF1
SCHEMBL7966785 0.88 CYP1A2 (0.72) EGFRERBB2ERBB4BRAFRAF1
SCHEMBL7978611 0.88 EGFR (0.64) EGFRERBB2ERBB4BRAFRAF1
SCHEMBL7982836 0.86 EGFR (0.63) EGFRERBB2ERBB4BRAFRAF1
SCHEMBL27756978 0.85 EGFR (0.67) EGFRERBB2ERBB4BRAFRAF1
SCHEMBL29894409 0.85 ABCG2 (0.76) EGFRERBB2GAKFBP1ALDH1A1
SCHEMBL183355 0.85 ABCG2 (0.76) EGFRERBB2GAKFBP1ALDH1A1

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