SCHEMBL4938141

SCHEMBL4938141

CN(C)c1ccccc1-c1cn2ncccc2n1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DYRK1A Q13627 5/20 0.36
FYN P06241 1/20 0.34
TGFBR1 P36897 3/20 0.33
DYRK3 O43781 1/20 0.33
CLK1 P49759 1/20 0.33
CLK2 P49760 1/20 0.33
CLK3 P49761 1/20 0.33
JAK3 P52333 1/20 0.33
CDK5 Q00535 1/20 0.33
CDK5R1 Q15078 1/20 0.33
PNCK Q6P2M8 1/20 0.33
HASPIN Q8TF76 1/20 0.33
DYRK2 Q92630 1/20 0.33
HIPK2 Q9H2X6 1/20 0.33
CLK4 Q9HAZ1 1/20 0.33
MKNK2 Q9HBH9 1/20 0.33
DYRK4 Q9NR20 1/20 0.33
STK39 Q9UEW8 1/20 0.33
WNK2 Q9Y3S1 1/20 0.33
DYRK1B Q9Y463 1/20 0.33

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
SCHEMBL2586809 0.75 HTR2C (0.41) TGFBR1KDM4ENPC1ALDH1A1MAPT
SCHEMBL4938134 0.74 APP (0.54) TLR9
SCHEMBL4089296 0.73 SLC6A2 (0.36) ATRNPC1RAB9A
SCHEMBL1202800 0.72 ALDH1A1 (0.49) CDK5CDK5R1CLK4KDM4ENPC1
SCHEMBL913532 0.71 APP (0.58) CDK5CDK5R1KDM4ENPC1PKM
SCHEMBL5048522 0.71 APP (0.58) DYRK1ACLK1CDK5CDK5R1KDM4E
SCHEMBL24697495 0.69 KDM4E (0.50) TGFBR1KDM4ENPC1PKMRAB9A
SCHEMBL31540362 0.69 KDM4E (0.50) TGFBR1KDM4ENPC1PKMRAB9A
SCHEMBL19305211 0.69 KDM4E (0.33) DYRK1ATGFBR1KDM4ENPC1PKM
SCHEMBL19305214 0.68 TGFBR1 (0.35) DYRK1ATGFBR1KDM4EALDH1A1

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
US-20080219922-A1 Alzheimer's Disease Imaging Agents EMORY UNIVERSITY 2008-09-11 US disclosed
WO-2007033080-A2 ALZHEIMER'S DISEASE IMAGING AGENTS EMORY UNIVERSITY (US) 2007-03-22 WO 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-20080219922-A1 Alzheimer's Disease Imaging Agents APP, PSEN1, MAPT DYRK1A 2830/4885FYN 429/4885TGFBR1 3801/4885

“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.