SCHEMBL18944167

SCHEMBL18944167

O=C(c1cc(-c2cnc3[nH]c(-c4ccccc4)cc3c2)ccn1)N1CCC(O)CC1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ULK1 O75385 4/20 0.46
RIPK1 Q13546 6/20 0.44
FGFR3 P22607 1/20 0.44
BRD4 O60885 1/20 0.42
KIT P10721 3/20 0.42
HTR2B P41595 1/20 0.41
PLK4 O00444 1/20 0.41
JAK2 O60674 1/20 0.41
MAP4K4 O95819 1/20 0.41
ROS1 P08922 1/20 0.41
FGFR1 P11362 1/20 0.41
FLT1 P17948 1/20 0.41
MARK3 P27448 1/20 0.41
FLT4 P35916 1/20 0.41
KDR P35968 1/20 0.41
FLT3 P36888 1/20 0.41
CLK2 P49760 1/20 0.41
CSNK1G2 P78368 1/20 0.41
MAP4K2 Q12851 1/20 0.41
ROCK1 Q13464 1/20 0.41

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
SCHEMBL18944169 0.94 FGFR3 (0.46) ULK1RIPK1FGFR3BRD4KIT
SCHEMBL18918931 0.92 ULK1 (0.46) ULK1RIPK1FGFR3BRD4KIT
SCHEMBL18932420 0.91 ULK1 (0.46) ULK1RIPK1FGFR3BRD4KIT
SCHEMBL18918872 0.89 ULK1 (0.45) ULK1RIPK1FGFR3BRD4KIT
SCHEMBL18943990 0.88 PLK4 (0.54) ULK1RIPK1BRD4PLK4JAK2
SCHEMBL18932425 0.88 ULK1 (0.44) ULK1RIPK1FGFR3BRD4KIT
SCHEMBL18944104 0.85 ULK1 (0.49) ULK1RIPK1BRD4KITHTR2B
SCHEMBL18944095 0.84 BRD4 (0.45) ULK1RIPK1BRD4KITPLK4
SCHEMBL18944105 0.83 ATR (0.54) ULK1RIPK1BRD4PLK4JAK2
SCHEMBL18944096 0.82 ULK1 (0.42) ULK1RIPK1BRD4KITHTR2B

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
US-20170158690-A1 COMPOUNDS AND METHODS FOR KINASE MODULATION, AND INDICATIONS THEREFOR PLEXXIKON INC. 2017-06-08 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20170158690-A1 COMPOUNDS AND METHODS FOR KINASE MODULATION, AND INDICATIONS THEREFOR MAP3K11, MAP3K13, WEE2 ULK1 495/4885RIPK1 1306/4885FGFR3 393/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.