SCHEMBL6181200

SCHEMBL6181200

COc1cc2ncnc(Nc3ccc4ccccc4c3)c2cc1OC

nearest known ligand 0.74

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EGFR P00533 14/20 0.74
KDR P35968 8/20 0.74
RET P07949 7/20 0.74
CLK1 P49759 1/20 0.74
ABCG2 Q9UNQ0 1/20 0.74
LCK P06239 4/20 0.72
RIPK2 O43353 2/20 0.72
EPHB2 P29323 1/20 0.72
SRC P12931 1/20 0.71
KIF5B P33176 1/20 0.67
FLT1 P17948 1/20 0.67
GAK O14976 1/20 0.67
STK10 O94804 1/20 0.67
FLT3 P36888 1/20 0.67
JAK3 P52333 1/20 0.67
AAK1 Q2M2I8 1/20 0.67
Q6ZSR9 Q6ZSR9 1/20 0.67
SLK Q9H2G2 1/20 0.67
IRAK4 Q9NWZ3 1/20 0.67
RPS6KA6 Q9UK32 1/20 0.67

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
Hydrochloric Acid SCHEMBL6180787 0.99 EGFR (0.74) EGFRKDRRETCLK1ABCG2
SCHEMBL156167 0.90 EGFR (0.69) EGFRKDRRETCLK1ABCG2
SCHEMBL8976743 0.86 EGFR (0.69) EGFRKDRRETCLK1ABCG2
SCHEMBL14982748 0.86 LRRK2 (0.67) EGFRKDRRETCLK1ABCG2
SCHEMBL15050338 0.85 EGFR (0.71) EGFRKDRRETCLK1ABCG2
Hydrochloric Acid SCHEMBL8976577 0.85 EGFR (0.70) EGFRKDRRETCLK1ABCG2
SCHEMBL1387182 0.85 EGFR (0.94) EGFRKDRRETCLK1ABCG2
SCHEMBL5565137 0.85 EGFR (1.00) EGFRKDRRETCLK1ABCG2
SCHEMBL1257431 0.85 EGFR (1.00) EGFRKDRRETCLK1ABCG2
SCHEMBL29515328 0.85 EGFR (1.00) EGFRKDRRETCLK1ABCG2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0871448-B1 ARYL AND HETEROARYL QUINAZOLINE COMPOUNDS WHICH INHIBIT CSF-1R RECEPTOR TYROSINE KINASE AVENTIS PHARMA INC (US) 2005-03-02 EP claimed
CN-1100540-C Protein tyrosine kinase aryl and heteroaryl quinazoline compounds having selective inhibition of HER-2 autophosphorylation properties AVENTIS PHARMA INC (US) 2003-02-05 CN claimed
US-RE37650-E1 Aryl and heteroaryl quinazoline compounds which inhibit CSF-1R receptor tyrosine kinase AVENTIS PHARMACETICAL PRODUCTS, INC. 2002-04-09 US claimed
CN-1187129-A Protein tyrosine kinase aryl and heteroaryl quinazoline compounds having selective inhibition of HER-2 autophosphorylation properties RHONE POULENC RORER PHARMA (US) 1998-07-08 CN claimed
EP-0831831-A4 PROTEIN TYROSINE KINASE ARYL AND HETEROARYL QUINAZOLINE COMPOUNDS HAVING SELECTIVE INHIBITION OF HER-2 AUTOPHOSPHORYLATION PROPERTIES RHONE POULENC RORER PHARMA (US) 1998-05-27 EP claimed
EP-0831831-A1 PROTEIN TYROSINE KINASE ARYL AND HETEROARYL QUINAZOLINE COMPOUNDS HAVING SELECTIVE INHIBITION OF HER-2 AUTOPHOSPHORYLATION PROPERTIES RHONE-POULENC RORER PHARMACEUTICALS, INC. (US) 1998-04-01 EP claimed
US-5721237-A ADMINISTERING FOR THE SELECTIVE TREATMENT OF CELL GROWTH AND DIFFERENTIATION RHONE-POULENC RORER PHARMACEUTICALS INC. (US) 1998-02-24 US claimed
US-5710158-A INHIBITORS OF PROTEIN TYROSINE KINASE AND EPIDERMAL GROWTH FACTOR RHONE-POULENC RORER PHARMACEUTICALS INC. (US) 1998-01-20 US claimed
WO-1996039145-A1 PROTEIN TYROSINE KINASE ARYL AND HETEROARYL QUINAZOLINE COMPOUNDS HAVING SELECTIVE INHIBITION OF HER-2 AUTOPHOSPHORYLATION PROPERTIES RHONE-POULENC RORER PHARMACEUTICALS INC. (US) 1996-12-12 WO claimed
CN-1100540-C Protein tyrosine kinase aryl and heteroaryl quinazoline compounds having selective inhibition of HER-2 autophosphorylation properties AVENTIS PHARMA INC (US) 2003-02-05 CN disclosed
CN-1187129-A Protein tyrosine kinase aryl and heteroaryl quinazoline compounds having selective inhibition of HER-2 autophosphorylation properties RHONE POULENC RORER PHARMA (US) 1998-07-08 CN disclosed