SCHEMBL28801394

SCHEMBL28801394

COc1ccc(Nc2ncnc3ccc(-c4cccc(N)c4)cc23)cc1Cl

nearest known ligand 0.67

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
BRAF P15056 15/20 0.67
RAF1 P04049 14/20 0.67
RET P07949 1/20 0.59
KDR P35968 1/20 0.59
MEN1 O00255 1/20 0.56
USP2 O75604 1/20 0.56
LMNA P02545 1/20 0.56
CYP1A2 P05177 1/20 0.56
CYP3A4 P08684 1/20 0.56
CYP2C9 P11712 1/20 0.56
TSHR P16473 1/20 0.56
MAPK1 P28482 1/20 0.56
CYP2C19 P33261 1/20 0.56
KMT2A Q03164 1/20 0.56
HSD17B10 Q99714 1/20 0.56
CLK4 Q9HAZ1 1/20 0.56
EGFR P00533 3/20 0.54
GAK O14976 1/20 0.54

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
SCHEMBL27890908 0.88 RAF1 (0.70) BRAFRAF1RETKDREGFR
SCHEMBL17845962 0.88 RAF1 (0.59) BRAFRAF1KDREGFR
SCHEMBL27907693 0.86 BRAF (0.71) BRAFRAF1KDREGFR
SCHEMBL27907697 0.86 EGFR (0.62) BRAFRAF1MEN1USP2LMNA
SCHEMBL28801011 0.85 RAF1 (0.60) BRAFRAF1KDREGFR
SCHEMBL27890907 0.85 BRAF (0.59) BRAFRAF1KDRMEN1USP2
SCHEMBL27987180 0.84 RAF1 (0.72) BRAFRAF1EGFR
SCHEMBL27907718 0.82 RAF1 (0.60) BRAFRAF1KDREGFR
SCHEMBL27986782 0.82 EGFR (0.61) BRAFRAF1KDREGFR
SCHEMBL27907739 0.82 RAF1 (0.66) BRAFRAF1KDREGFR

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-102702116-B 4-(3-chloro-4-methoxylanilino)-6-(3-amidophenyl)quinazoline compound or pharmaceutically-acceptable salt thereof and preparation methods and applications thereof UNIV SOUTH CHINA TECH 2014-12-31 CN disclosed
CN-102702116-B 4-(3-chloro-4-methoxylanilino)-6-(3-amidophenyl)quinazoline compound or pharmaceutically-acceptable salt thereof and preparation methods and applications thereof UNIV SOUTH CHINA TECH 2014-12-31 CN disclosed
CN-102702116-A 4-(3-chloro-4-methoxylanilino)-6-(3-amidophenyl)quinazoline compound or pharmaceutically-acceptable salt thereof and preparation methods and applications thereof UNIV SOUTH CHINA TECH 2012-10-03 CN disclosed
CN-102702116-A 4-(3-chloro-4-methoxylanilino)-6-(3-amidophenyl)quinazoline compound or pharmaceutically-acceptable salt thereof and preparation methods and applications thereof UNIV SOUTH CHINA TECH 2012-10-03 CN disclosed