SCHEMBL13655330

SCHEMBL13655330

c1cc(CNCc2ccc3[nH]c(-c4n[nH]c5c4CCCC5)cc3c2)ccn1

nearest known ligand 0.39

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
CLK2 P49760 3/20 0.39
CLK3 P49761 3/20 0.39
DYRK1A Q13627 3/20 0.39
PIP5K1C O60331 4/20 0.38
CHEK1 O14757 6/20 0.38
CDK7 P50613 6/20 0.38
PARP14 Q460N5 1/20 0.37
NAMPT P43490 1/20 0.37
HTT P42858 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
NPSR1 Q6W5P4 1/20 0.36
MMP13 P45452 1/20 0.35
LMNA P02545 1/20 0.34
MAPK10 P53779 1/20 0.34

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
SCHEMBL13655332 0.85 PIP5K1C (0.40) PIP5K1CCHEK1CDK7HTTNPSR1
SCHEMBL13655325 0.85 MC4R (0.40) PIP5K1CCHEK1CDK7HTTNPSR1
SCHEMBL13655346 0.82 CHEK1 (0.46) CLK2CLK3DYRK1APIP5K1CCHEK1
SCHEMBL13655342 0.81 TERT (0.41) CLK2CLK3DYRK1APIP5K1CCHEK1
SCHEMBL13655331 0.80 KDM4E (0.43) PIP5K1CCHEK1CDK7SMN1; SMN2
SCHEMBL13655336 0.79 CHEK1 (0.46) PIP5K1CCHEK1CDK7
SCHEMBL13655345 0.78 CLK2 (0.42) CLK2CLK3DYRK1APIP5K1CCHEK1
SCHEMBL13655335 0.78 PIP5K1C (0.44) PIP5K1CCHEK1CDK7
SCHEMBL13655343 0.76 CHEK1 (0.45) PIP5K1CCHEK1CDK7
SCHEMBL13655326 0.74 CHEK1 (0.60) CHEK1CDK7

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-20090247504-A1 Indazole Derivatives for Treatment of Alzheimer's Disease MERCK SHARP & DOHME LIMITED (GB) 2009-10-01 US disclosed
US-20090247504-A1 Indazole Derivatives for Treatment of Alzheimer's Disease MERCK SHARP & DOHME LIMITED (GB) 2009-10-01 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-20090247504-A1 Indazole Derivatives for Treatment of Alzheimer's Disease MAPT, PSEN2, PSEN1 CLK2 685/4885CLK3 1342/4885DYRK1A 1225/4885

“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.