SCHEMBL13624324

SCHEMBL13624324

CC[C@@H](CNc1ccc(OC)cc1OC)NC(=O)[C@@H](N[C@@H](c1ccccc1)C(F)(F)F)[C@@H](C)CC

nearest known ligand 0.47

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
TAS1R3 Q7RTX0 1/20 0.47
TAS1R1 Q7RTX1 1/20 0.47
MEN1 O00255 3/20 0.46
KMT2A Q03164 3/20 0.46
HTT P42858 1/20 0.41
CTSK P43235 1/20 0.41
CTSL P07711 2/20 0.40
LPAR1 Q92633 1/20 0.39
GAA P10253 1/20 0.39
CTSD P07339 1/20 0.38
GPR88 Q9GZN0 1/20 0.38
NPC1 O15118 1/20 0.38
RAB9A P51151 1/20 0.38
MAPT P10636 1/20 0.37
TDP1 Q9NUW8 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
SCHEMBL13624172 0.86 TAS1R3 (0.47) TAS1R3TAS1R1MEN1KMT2AHTT
SCHEMBL13624321 0.85 CTSL (0.57) TAS1R3TAS1R1MEN1KMT2ACTSK
SCHEMBL13624323 0.85 TAS1R3 (0.46) TAS1R3TAS1R1MEN1KMT2AHTT
SCHEMBL13624327 0.83 TAS1R3 (0.44) TAS1R3TAS1R1MEN1KMT2AHTT
SCHEMBL13624329 0.82 CTSL (0.52) MEN1KMT2ACTSKCTSL
SCHEMBL13624358 0.82 CTSL (0.52) TAS1R3TAS1R1MEN1KMT2ACTSK
SCHEMBL4370734 0.81 CTSL (0.41) TAS1R3TAS1R1MEN1KMT2ACTSK
SCHEMBL4370748 0.81 CTSL (0.41) TAS1R3TAS1R1MEN1KMT2ACTSK
SCHEMBL13624401 0.80 CTSK (0.51) CTSKCTSL
SCHEMBL4374220 0.80 CTSL (0.40) TAS1R3TAS1R1MEN1KMT2ACTSK

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-20090291945-A1 CYSTEINE PROTEASE INHIBITORS TEIJIN PHARMA LIMITED (JP) 2009-11-26 US disclosed
US-20090291945-A1 CYSTEINE PROTEASE INHIBITORS TEIJIN PHARMA LIMITED (JP) 2009-11-26 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-20090291945-A1 CYSTEINE PROTEASE INHIBITORS CTSE, SPINT2, CTSF TAS1R3 3970/4885TAS1R1 3363/4885MEN1 1994/4885

“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.