SCHEMBL21165338

SCHEMBL21165338

CCC(C)CNC(=O)c1c(F)c(F)c(C)c(F)c1F

nearest known ligand 0.73

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
TAS1R3 Q7RTX0 14/20 0.73
TAS1R1 Q7RTX1 13/20 0.73
TAS1R2 Q8TE23 13/20 0.73
PKM P14618 1/20 0.49
SMN1; SMN2 Q16637 1/20 0.49
HTT P42858 1/20 0.42
RECQL P46063 1/20 0.39
NAMPT P43490 2/20 0.36
TSHR P16473 1/20 0.36

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
SCHEMBL705624 0.84 TAS1R3 (1.00) TAS1R3TAS1R1TAS1R2PKMSMN1; SMN2
SCHEMBL22222488 0.76 PKM (0.83) TAS1R3TAS1R1TAS1R2PKMSMN1; SMN2
SCHEMBL4172967 0.74 TAS1R3 (0.82) TAS1R3TAS1R1TAS1R2PKMSMN1; SMN2
SCHEMBL20662856 0.74 TAS1R3 (0.79) TAS1R3TAS1R1TAS1R2PKMSMN1; SMN2
SCHEMBL21165257 0.71 TAS1R3 (0.51) TAS1R3TAS1R1TAS1R2PKMSMN1; SMN2
SCHEMBL2332543 0.69
SCHEMBL22311455 0.69
SCHEMBL13350424 0.69 GAA (0.55) SMN1; SMN2HTTNAMPT
SCHEMBL17865782 0.69 NAMPT (0.58) SMN1; SMN2HTTNAMPT
SCHEMBL700840 0.68 TAS1R3 (1.00) TAS1R3TAS1R1TAS1R2PKMSMN1; SMN2

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-10352929-B2 T1R hetero-oligomeric taste receptors, cell lines that express said receptors, and taste compounds SENOMYX, INC. (US) 2019-07-16 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-10352929-B2 T1R hetero-oligomeric taste receptors, cell lines that express said receptors, and taste compounds TAS1R2, TAS1R1, TAS2R1 TAS1R3 4/4885TAS1R1 2/4885TAS1R2 1/4885

“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.