SCHEMBL4870283

SCHEMBL4870283

O=[C]c1cnc(Nc2cccc(OCCN3CCCC3)c2)nc1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SRC P12931 3/20 0.51
YES1 P07947 2/20 0.51
JAK2 O60674 3/20 0.49
JAK3 P52333 3/20 0.49
BRD4 O60885 3/20 0.49
BRDT Q58F21 2/20 0.49
BRD2 P25440 1/20 0.49
BRD3 Q15059 1/20 0.49
CHRNB2 P17787 1/20 0.49
CHRNA4 P43681 1/20 0.49
LTA4H P09960 3/20 0.48
SYK P43405 3/20 0.48
JAK1 P23458 2/20 0.48
EGFR P00533 2/20 0.48
BTK Q06187 2/20 0.48
FGFR1 P11362 2/20 0.48
BRAF P15056 2/20 0.48
BMPR1B O00238 1/20 0.48
PLK4 O00444 1/20 0.48
STK25 O00506 1/20 0.48

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
SCHEMBL12190209 0.85 SRC (0.56) SRCYES1JAK2JAK3BRD4
SCHEMBL4880015 0.85 AIMP2 (0.57) SRCYES1CHRNB2CHRNA4LTA4H
SCHEMBL2498311 0.83 POLB (0.53) SRCYES1JAK2JAK3BRD4
SCHEMBL2498319 0.83 SRC (0.49) SRCYES1JAK2JAK3BRD4
SCHEMBL2498478 0.82 KDM4E (0.54) SRCYES1JAK2JAK3BRD4
SCHEMBL5994756 0.80 SRC (0.51) SRCYES1CHRNB2CHRNA4LTA4H
SCHEMBL5215607 0.79 LTA4H (0.61) LTA4HKDM4EALDH1A1SMN1; SMN2BACE1
SCHEMBL5995311 0.79 SRC (0.54) SRCYES1JAK2JAK3BRD4
SCHEMBL5998263 0.79 LCK (0.55) SRCYES1SYKEGFRBTK
SCHEMBL5215621 0.78 BACE1 (0.62) LTA4HHRH3KDM4EALDH1A1SMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2008008234-A1 2-AMINO-5-SUBSTITUTED PYRIMIDINE INHIBITORS TARGEGEN, INC. (US) 2008-01-17 WO disclosed