SCHEMBL1940135

SCHEMBL1940135

Nc1ncnc2c1c(C(=O)c1cccc(NC(=O)NC3CCCCC3)c1)cn2CC1CC1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EGFR P00533 8/20 0.58
ERBB2 P04626 8/20 0.58
ERBB3 P21860 7/20 0.58
ERBB4 Q15303 7/20 0.58
TEK Q02763 6/20 0.58
KDR P35968 3/20 0.57
PDGFRB P09619 1/20 0.50
PKM P14618 1/20 0.48
ALOX15 P16050 1/20 0.48
MAP4K4 O95819 1/20 0.47
SMN1; SMN2 Q16637 2/20 0.42
NPC1 O15118 5/20 0.42
RAB9A P51151 5/20 0.42
MEN1 O00255 2/20 0.42
KMT2A Q03164 2/20 0.42
LMNA P02545 1/20 0.42
EPHX1 P07099 1/20 0.42
TSHR P16473 1/20 0.42
EPHX2 P34913 1/20 0.42
GAA P10253 1/20 0.42

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
SCHEMBL1940561 0.87 TEK (0.60) EGFRERBB2ERBB3ERBB4TEK
SCHEMBL1941056 0.86 EGFR (0.61) EGFRERBB2ERBB3ERBB4TEK
SCHEMBL1941729 0.86 EGFR (0.60) EGFRERBB2ERBB3ERBB4TEK
SCHEMBL1939355 0.86 EGFR (0.77) EGFRERBB2ERBB3ERBB4TEK
SCHEMBL1940944 0.85 EGFR (0.79) EGFRERBB2ERBB3ERBB4TEK
SCHEMBL1940603 0.85 EGFR (0.64) EGFRERBB2ERBB3ERBB4TEK
SCHEMBL1940247 0.84 PDGFRB (0.71) EGFRERBB2ERBB3ERBB4TEK
SCHEMBL1940842 0.84 EGFR (0.77) EGFRERBB2ERBB3ERBB4TEK
SCHEMBL1940556 0.84 EGFR (0.80) EGFRERBB2ERBB3ERBB4TEK
SCHEMBL1940713 0.83 EGFR (0.74) 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