SCHEMBL4162633

SCHEMBL4162633

CCC(C)NC(=O)c1c(C)cc(C)cc1C

nearest known ligand 0.63

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.63
CYP1A2 P05177 1/20 0.63
CYP2C9 P11712 1/20 0.63
PKM P14618 1/20 0.56
SMN1; SMN2 Q16637 1/20 0.56
MEN1 O00255 1/20 0.47
KMT2A Q03164 1/20 0.47
MAPK1 P28482 1/20 0.46
ALDH1A1 P00352 4/20 0.45
RAB9A P51151 2/20 0.45
MMP1 P03956 1/20 0.43
MMP2 P08253 1/20 0.43
MMP3 P08254 1/20 0.43
HTT P42858 1/20 0.43
TAS1R3 Q7RTX0 2/20 0.42
TAS1R1 Q7RTX1 2/20 0.42
TAS1R2 Q8TE23 2/20 0.42
ITGB1 P05556 1/20 0.42
ITGA4 P13612 1/20 0.42
HPGD P15428 2/20 0.41

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
SCHEMBL21281612 0.81 TAS1R3 (0.51) TSHRCYP1A2CYP2C9KMT2AALDH1A1
SCHEMBL4170005 0.80 TAS1R3 (0.48) TSHRCYP1A2CYP2C9SMN1; SMN2MEN1
SCHEMBL4180224 0.78 TAS1R3 (0.53) TSHRCYP1A2CYP2C9SMN1; SMN2KMT2A
SCHEMBL18205653 0.77 MAPK1 (0.56) TSHRCYP1A2CYP2C9PKMSMN1; SMN2
SCHEMBL6171665 0.76 MAPK1 (0.55) TSHRCYP1A2CYP2C9PKMSMN1; SMN2
SCHEMBL4169220 0.75 TAS1R3 (0.56) SMN1; SMN2MEN1KMT2AALDH1A1HTT
SCHEMBL4175264 0.75 TAS1R3 (0.56) SMN1; SMN2MEN1KMT2AALDH1A1HTT
SCHEMBL4166621 0.75 TAS1R3 (0.56) SMN1; SMN2MEN1KMT2AALDH1A1HTT
SCHEMBL2913713 0.75 MAPK1 (0.67) TSHRCYP1A2CYP2C9PKMSMN1; SMN2
SCHEMBL15506869 0.75 KDM4E (0.61) TSHRCYP1A2CYP2C9PKMSMN1; 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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090047379-A1 Benzamide Compounds Useful as High Potency Sweet Taste Enhancers DEWIS MARK L 2009-02-19 US disclosed
US-20090047379-A1 Benzamide Compounds Useful as High Potency Sweet Taste Enhancers DEWIS MARK L 2009-02-19 US disclosed
US-20090047379-A1 Benzamide Compounds Useful as High Potency Sweet Taste Enhancers DEWIS MARK L 2009-02-19 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-20090047379-A1 Benzamide Compounds Useful as High Potency Sweet Taste Enhancers TAS2R10, TAS2R50, TAS2R8 TSHR 3316/4885CYP1A2 3728/4885CYP2C9 3774/4885

“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.