SCHEMBL13634972

SCHEMBL13634972

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

nearest known ligand 0.41

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
CTSL P07711 9/20 0.41
TAS1R3 Q7RTX0 1/20 0.39
TAS1R1 Q7RTX1 1/20 0.39
CTSB P07858 8/20 0.38
CTSF Q9UBX1 8/20 0.38
MEN1 O00255 2/20 0.38
KMT2A Q03164 2/20 0.38
CTSK P43235 2/20 0.38
GPR88 Q9GZN0 1/20 0.36
ALDH1A1 P00352 1/20 0.35

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 0.93 TAS1R3 (0.47) CTSLTAS1R3TAS1R1CTSBCTSF
SCHEMBL4375019 0.92 CTSL (0.40) CTSLTAS1R3TAS1R1CTSBCTSF
SCHEMBL4367886 0.92 CTSK (0.43) CTSLTAS1R3TAS1R1CTSBCTSF
SCHEMBL4367894 0.92 CTSK (0.43) CTSLTAS1R3TAS1R1CTSBCTSF
SCHEMBL13624306 0.91 CTSL (0.42) CTSLTAS1R3TAS1R1CTSBCTSF
SCHEMBL4371069 0.90 CTSL (0.44) CTSLTAS1R3TAS1R1CTSBCTSF
SCHEMBL13624286 0.90 CTSL (0.41) CTSLTAS1R3TAS1R1CTSBCTSF
SCHEMBL13624419 0.89 CTSL (0.39) CTSLTAS1R3TAS1R1CTSBCTSF
SCHEMBL4367724 0.89 CTSL (0.41) CTSLTAS1R3TAS1R1CTSBCTSF
SCHEMBL4370748 0.89 CTSL (0.41) CTSLTAS1R3TAS1R1CTSBCTSF

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-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 CTSL 24/4885TAS1R3 3970/4885TAS1R1 3363/4885

“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.