SCHEMBL7851979

SCHEMBL7851979

CN(C)CCNC(=O)CCn1cc(-c2ccc(Oc3ccccc3)cc2)c2c(N)ncnc21

nearest known ligand 0.65

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
LCK P06239 6/20 0.65
SRC P12931 5/20 0.65
TEK Q02763 5/20 0.65
BTK Q06187 7/20 0.57
HCK P08631 7/20 0.51
FLT3 P36888 5/20 0.51
KDR P35968 4/20 0.51

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
SCHEMBL7853089 0.92 LCK (0.62) LCKSRCTEKBTKHCK
SCHEMBL6457819 0.91 LCK (0.61) LCKSRCTEKBTKHCK
SCHEMBL7853877 0.90 SRC (0.68) LCKSRCTEKBTKHCK
SCHEMBL7855243 0.87 SRC (0.68) LCKSRCTEKBTKHCK
SCHEMBL7843786 0.87 LCK (0.61) LCKSRCTEKBTKHCK
SCHEMBL6458737 0.86 LCK (0.62) LCKSRCTEKBTKHCK
SCHEMBL7852098 0.86 SRC (0.67) LCKSRCTEKBTKHCK
SCHEMBL7853262 0.86 SRC (0.66) LCKSRCTEKBTKHCK
SCHEMBL7842853 0.86 LCK (0.64) LCKSRCTEKBTKHCK
SCHEMBL7852451 0.85 LCK (0.66) LCKSRCTEKBTKHCK

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-1114053-A1 PYRROLOPYRIMIDINES AS PROTEIN KINASE INHIBITORS BASF AKTIENGESELLSCHAFT (DE) 2001-07-11 EP disclosed
WO-2000017203-A1 PYRROLOPYRIMIDINES AS PROTEIN KINASE INHIBITORS BASF AKTIENGESELLSCHAFT (DE) 2000-03-30 WO disclosed