SCHEMBL10141352

SCHEMBL10141352

Cc1nc2c([nH]1)-c1ccc(C(C)C)cc1CN(C)C2

nearest known ligand 0.36

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
NPSR1 Q6W5P4 1/20 0.36
LMNA P02545 1/20 0.35
EIF4A3 P38919 1/20 0.33
C5AR1 P21730 3/20 0.32
TLR9 Q9NR96 1/20 0.31
TLR8 Q9NR97 1/20 0.31
TLR7 Q9NYK1 1/20 0.31
PSMB5 P28074 1/20 0.31
PDE2A O00408 1/20 0.31
KDM1A O60341 1/20 0.31
HTR7 P34969 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
SCHEMBL10118797 0.87 NPSR1 (0.36) NPSR1LMNAEIF4A3C5AR1KDM1A
SCHEMBL10119927 0.84 NPSR1 (0.34) NPSR1EIF4A3
SCHEMBL15889025 0.83 RAB9A (0.36) PDE2A
SCHEMBL12327996 0.83 LMNA (0.39) NPSR1LMNAPSMB5PDE2A
SCHEMBL13561573 0.82 TYMS (0.39) NPSR1LMNAPSMB5PDE2A
SCHEMBL10141013 0.76 SLC6A2 (0.35)
SCHEMBL12328338 0.72 LMNA (0.36) LMNAPSMB5PDE2A
SCHEMBL12328339 0.71 HPGD (0.37) LMNAPSMB5PDE2A
SCHEMBL12294482 0.70 KDM4E (0.36) NPSR1LMNAEIF4A3PSMB5
SCHEMBL15705289 0.69 NPSR1 (0.42) NPSR1LMNAKDM1AHTR7

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-20120039848-A1 HEPATITIS C VIRUS INHIBITORS ENANTA PHARMACEUTICALS, INC. 2012-02-16 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-20120039848-A1 HEPATITIS C VIRUS INHIBITORS HAVCR2, SLC10A1, EIF2AK2 NPSR1 2789/4885LMNA 2800/4885EIF4A3 62/4885

“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.