SCHEMBL14870575

SCHEMBL14870575

Cc1cc(/C=C/C(=O)NC2CCc3ccccc32)ccc1-n1ccnc1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.49
TAOK1 Q7L7X3 1/20 0.43
TAOK3 Q9H2K8 1/20 0.43
CHRM4 P08173 3/20 0.40
TAS1R3 Q7RTX0 2/20 0.39
TAS1R1 Q7RTX1 2/20 0.39
TAS1R2 Q8TE23 1/20 0.39
TSHR P16473 1/20 0.38
MAOB P27338 1/20 0.38
PDE2A O00408 1/20 0.37
KDM4E B2RXH2 1/20 0.37
CCR2 P41597 1/20 0.37
ALDH1A1 P00352 1/20 0.37
LMNA P02545 1/20 0.37
HTT P42858 1/20 0.37
BRD4 O60885 1/20 0.37
PDE4A P27815 1/20 0.37
PDE4B Q07343 1/20 0.37
PDE4C Q08493 1/20 0.37
PDE4D Q08499 1/20 0.37

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
SCHEMBL12712224 0.94 SMN1; SMN2 (0.50) SMN1; SMN2TAOK1TAOK3CHRM4TAS1R3
SCHEMBL12713006 0.90 SMN1; SMN2 (0.48) SMN1; SMN2TAOK1TAOK3CHRM4TSHR
SCHEMBL1238861 0.90 SMN1; SMN2 (0.48) SMN1; SMN2TAOK1TAOK3CHRM4TAS1R3
SCHEMBL1238858 0.90 SMN1; SMN2 (0.48) SMN1; SMN2TAOK1TAOK3CHRM4TAS1R3
SCHEMBL1238717 0.89 SMN1; SMN2 (0.49) SMN1; SMN2TAOK1TAOK3CHRM4TAS1R3
SCHEMBL1238767 0.89 SMN1; SMN2 (0.49) SMN1; SMN2TAOK1TAOK3TAS1R3TAS1R1
SCHEMBL1238719 0.89 SMN1; SMN2 (0.49) SMN1; SMN2TAOK1TAOK3CHRM4TAS1R3
SCHEMBL1238769 0.89 SMN1; SMN2 (0.49) SMN1; SMN2TAOK1TAOK3TAS1R3TAS1R1
SCHEMBL1240045 0.89 SMN1; SMN2 (0.49) SMN1; SMN2TAOK1TAOK3TAS1R3TAS1R1
SCHEMBL1240047 0.89 SMN1; SMN2 (0.49) SMN1; SMN2TAOK1TAOK3TAS1R3TAS1R1

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-20130095068-A1 AGENT FOR TREATING HCV INFECTION EISAI R&D MANAGEMENT CO., LTD. (JP) 2013-04-18 US disclosed
US-20130095068-A1 AGENT FOR TREATING HCV INFECTION EISAI R&D MANAGEMENT CO., LTD. (JP) 2013-04-18 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-20130095068-A1 AGENT FOR TREATING HCV INFECTION EIF2AK2, IRF3, IFNAR1 SMN1; SMN2 3982/4885TAOK1 2949/4885TAOK3 3300/4885

“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.