SCHEMBL1940233

SCHEMBL1940233

Cc1c(Cl)cccc1NC(=O)Nc1cccc(C(=O)c2cn(C3CCCC3)c3ncnc(N)c23)c1

nearest known ligand 0.80

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
EGFR P00533 9/20 0.80
ERBB2 P04626 9/20 0.80
ERBB3 P21860 9/20 0.80
ERBB4 Q15303 9/20 0.80
TEK Q02763 8/20 0.78
KDR P35968 1/20 0.72
PDGFRB P09619 1/20 0.56
RET P07949 7/20 0.49
LCK P06239 1/20 0.49
SRC P12931 1/20 0.49
FLT3 P36888 1/20 0.45
NTRK2 Q16620 1/20 0.44
LMNA P02545 1/20 0.43
POLB P06746 1/20 0.43

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
SCHEMBL1941747 0.93 EGFR (0.87) EGFRERBB2ERBB3ERBB4TEK
SCHEMBL1941973 0.92 EGFR (0.78) EGFRERBB2ERBB3ERBB4TEK
SCHEMBL1940953 0.91 EGFR (0.84) EGFRERBB2ERBB3ERBB4TEK
SCHEMBL1941864 0.91 EGFR (0.83) EGFRERBB2ERBB3ERBB4TEK
SCHEMBL1939851 0.90 EGFR (0.77) EGFRERBB2ERBB3ERBB4TEK
SCHEMBL1941102 0.90 EGFR (0.82) EGFRERBB2ERBB3ERBB4TEK
SCHEMBL1942866 0.89 EGFR (0.83) EGFRERBB2ERBB3ERBB4TEK
SCHEMBL1940682 0.89 EGFR (0.88) EGFRERBB2ERBB3ERBB4TEK
SCHEMBL1940667 0.89 EGFR (0.89) EGFRERBB2ERBB3ERBB4TEK
SCHEMBL1940004 0.89 EGFR (0.82) EGFRERBB2ERBB3ERBB4TEK

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
EP-1578751-B1 PYRROLOPYRIMIDINE DERIVATIVES PFIZER PROD INC (US) 2011-06-15 EP disclosed
CN-1726218-A Pyrrolopyrimidine derivatives PFIZER PROD INC (US) 2006-01-25 CN disclosed