SCHEMBL13360502

SCHEMBL13360502

CCc1ccc(C(=O)NCCC(C)C)cc1

nearest known ligand 0.65

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.65
RAB9A P51151 2/20 0.65
NPC1 O15118 1/20 0.65
PLK1 P53350 1/20 0.56
TAS1R3 Q7RTX0 1/20 0.55
TAS1R1 Q7RTX1 1/20 0.55
LMNA P02545 2/20 0.55
NAMPT P43490 2/20 0.50
ESRRG P62508 1/20 0.50
HTT P42858 1/20 0.50
ALDH1A1 P00352 3/20 0.49
TDP1 Q9NUW8 1/20 0.49
POLB P06746 1/20 0.48
KCNA5 P22460 1/20 0.48
TAOK1 Q7L7X3 1/20 0.48
TAOK3 Q9H2K8 1/20 0.48

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
SCHEMBL17887994 0.89 SMN1; SMN2 (0.77) SMN1; SMN2RAB9ANPC1LMNANAMPT
SCHEMBL13814872 0.87 PLK1 (0.53) SMN1; SMN2RAB9ANPC1PLK1TAS1R3
SCHEMBL13328247 0.87 SMN1; SMN2 (0.65) SMN1; SMN2RAB9ANPC1LMNANAMPT
SCHEMBL23589794 0.83 NPC1 (0.54) SMN1; SMN2RAB9ANPC1PLK1TAS1R3
SCHEMBL14297350 0.83 NPC1 (0.69) SMN1; SMN2RAB9ANPC1LMNANAMPT
SCHEMBL17301589 0.83 SMN1; SMN2 (0.69) SMN1; SMN2RAB9ANPC1LMNANAMPT
SCHEMBL10268332 0.83 HPGD (0.64) SMN1; SMN2RAB9ANPC1PLK1TAS1R3
SCHEMBL24648929 0.83 SMN1; SMN2 (0.69) SMN1; SMN2RAB9ANPC1LMNANAMPT
SCHEMBL6570929 0.83 SMN1; SMN2 (0.69) SMN1; SMN2RAB9ANPC1LMNANAMPT
SCHEMBL19602703 0.83 SMN1; SMN2 (0.60) SMN1; SMN2RAB9ANPC1LMNANAMPT

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-20200268898-A1 GLP-1 RECEPTOR LIGAND MOIETY CONJUGATED OLIGONUCLEOTIDES AND USES THEREOF IONIS PHARMACEUTICALS, INC. 2020-08-27 US disclosed
US-7713944-B2 Oligomers comprising activated disulfides which bind to plasma proteins and their use for delivery to cells ISIS PHARMACEUTICALS, INC. (US) 2010-05-11 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-20200268898-A1 GLP-1 RECEPTOR LIGAND MOIETY CONJUGATED OLIGONUCLEOTIDES AND USES THEREOF GLP1R, GIPR, GRPR SMN1; SMN2 3594/4885RAB9A 2724/4885NPC1 2667/4885

“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.