SCHEMBL14045906

SCHEMBL14045906

N#Cc1cccc(Nc2ncc(CNCC3CC3)c(CF)n2)c1

nearest known ligand 0.49

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
SYK P43405 4/20 0.49
CNR2 P34972 4/20 0.46
CDC7 O00311 1/20 0.44
MAOB P27338 1/20 0.44
GRM5 P41594 1/20 0.44
PRKCQ Q04759 3/20 0.43
IGF1R P08069 1/20 0.42
VNN1 O95497 2/20 0.42
EGFR P00533 1/20 0.40
BTK Q06187 1/20 0.40
KMT2A Q03164 1/20 0.40
TSHR P16473 1/20 0.39
ZAP70 P43403 1/20 0.39
PTK2 Q05397 1/20 0.39

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
SCHEMBL14026161 0.85 CNR2 (0.58) SYKCNR2CDC7MAOBGRM5
SCHEMBL14045929 0.83 SYK (0.57) SYKCNR2CDC7MAOBGRM5
SCHEMBL14045886 0.83 SYK (0.50) SYKCNR2CDC7MAOBGRM5
Formic Acid SCHEMBL4895900 0.82 CNR2 (0.57) SYKCNR2CDC7MAOBGRM5
SCHEMBL14045934 0.77 SYK (0.57) SYKCNR2CDC7MAOBGRM5
SCHEMBL14045917 0.76 CDK1 (0.52) SYKCNR2CDC7MAOBGRM5
SCHEMBL14026150 0.71 CNR2 (0.55) SYKCNR2CDC7MAOBGRM5
Formic Acid SCHEMBL4894255 0.71 CNR2 (0.55) SYKCNR2CDC7MAOBGRM5
SCHEMBL14026143 0.71 CNR2 (0.56) CNR2PRKCQ
SCHEMBL3379477 0.70 CNR2 (0.76) CNR2

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-20080261977-A1 Pyrimidine Derivatives as Cannabinoid Receptor Modulators GLAXO GROUP LIMITED (GB) 2008-10-23 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-20080261977-A1 Pyrimidine Derivatives as Cannabinoid Receptor Modulators CNR2, CNR1, P2RY2 SYK 2878/4885CNR2 1/4885CDC7 2558/4885

“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.