SCHEMBL16355261

SCHEMBL16355261

Cc1cc(O)nc(C)c1CN

nearest known ligand 0.38

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.38
DPP4 P27487 6/20 0.34
DPP8 Q6V1X1 2/20 0.34
HTR1D P28221 1/20 0.31
KDM4E B2RXH2 2/20 0.30
MAPT P10636 2/20 0.30
ALDH1A1 P00352 1/20 0.30
GAA P10253 1/20 0.30
SMN1; SMN2 Q16637 1/20 0.30
PDE10A Q9Y233 1/20 0.30

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
Hydrochloric Acid SCHEMBL15142756 0.98 LMNA (0.37) LMNADPP4DPP8HTR1D
SCHEMBL18368343 0.78 POLB (0.38) LMNADPP4DPP8HTR1DKDM4E
SCHEMBL7337621 0.77 NOS3 (0.41)
SCHEMBL30000766 0.77 NOS3 (0.41)
Hydrochloric Acid SCHEMBL17442571 0.75 NOS3 (0.41)
Hydrochloric Acid SCHEMBL7823971 0.75 NOS3 (0.41)
SCHEMBL17221363 0.72 MEN1 (0.37) DPP4DPP8
SCHEMBL17221585 0.72 NOS3 (0.39) DPP4DPP8
SCHEMBL17221566 0.72 POLB (0.41) LMNADPP4KDM4EALDH1A1SMN1; SMN2
SCHEMBL12499744 0.71 POLB (0.40) LMNADPP4DPP8HTR1DKDM4E

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-20140378474-A1 5-membered heteroarylcarboxamide derivatives as plasma kallikrein inhibitors NOVARTIS AG (CH) 2014-12-25 US disclosed
US-20140378474-A1 5-membered heteroarylcarboxamide derivatives as plasma kallikrein inhibitors NOVARTIS AG (CH) 2014-12-25 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-20140378474-A1 5-membered heteroarylcarboxamide derivatives as plasma kallikrein inhibitors KLKB1, KLK5, KLK1 LMNA 1206/4885DPP4 206/4885DPP8 95/4885

“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.