SCHEMBL26534342

SCHEMBL26534342

CCC[C@H](NC(=O)c1cc2ccccc2[nH]1)C(=O)N[C@H](CC#N)C[C@@H]1CCNC1O

nearest known ligand 0.50

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 1/20 0.50
CCKBR P32239 4/20 0.42
CYP51A1 Q16850 1/20 0.42
GAA P10253 1/20 0.42
HPGD P15428 1/20 0.42
CTSL P07711 1/20 0.41
CTSS P25774 1/20 0.41
TAS1R3 Q7RTX0 1/20 0.41
TAS1R1 Q7RTX1 1/20 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
SCHEMBL24960973 0.84
SCHEMBL24960909 0.78 CTSL (0.52) CTSLCTSS
SCHEMBL24960911 0.75 CTSL (0.60) CTSLCTSS
SCHEMBL24960976 0.74
SCHEMBL24960974 0.74 CTSL (0.62) CTSLCTSS
SCHEMBL26224037 0.72 F2R (0.49)
SCHEMBL24960912 0.72 F2R (0.49)
SCHEMBL24961120 0.72 F2R (0.52) CCKBRCYP51A1CTSS
SCHEMBL24960419 0.71
SCHEMBL25861546 0.70

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-20230322668-A1 PROTEASE INHIBITORS AS ANTIVIRALS ACEA Therapeutics, Inc. (US) 2023-10-12 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-20230322668-A1 PROTEASE INHIBITORS AS ANTIVIRALS ACE, ACE2, TMPRSS15 DRD2 4624/4885CCKBR 1799/4885CYP51A1 282/4885

“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.