SCHEMBL30133609

SCHEMBL30133609

O=C[C@H](Cc1ccccc1)NC(=O)c1csnc1-c1ccccc1

nearest known ligand 0.56

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ CAPN1 P07384 12/20 0.56
▸ ACE P12821 1/20 0.43
▸ CTSB P07858 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
SCHEMBL20027682 1.00 CAPN1 (0.56) CAPN1ACECTSB
SCHEMBL30133574 0.80 CAPN1 (0.60) CAPN1CTSB
SCHEMBL20027691 0.80 CAPN1 (0.60) CAPN1CTSB
SCHEMBL20027780 0.80 CAPN1 (0.51) CAPN1ACECTSB
SCHEMBL20027878 0.78 CAPN1 (0.55) CAPN1CTSB
SCHEMBL20027730 0.78 CAPN1 (0.55) CAPN1CTSB
SCHEMBL7377270 0.77 CAPN1 (0.67) CAPN1ACE
SCHEMBL7375338 0.77 CAPN1 (0.67) CAPN1ACE
SCHEMBL22897077 0.77 CAPN1 (0.57) CAPN1CTSB
SCHEMBL22897295 0.76 CAPN1 (0.50) CAPN1ACECTSB

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-20220324814-A1 CALPAIN MODULATORS AND THERAPEUTIC USES THEREOF BLADE THERAPEUTICS INC (US) 2022-10-13 — — 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-20220324814-A1 CALPAIN MODULATORS AND THERAPEUTIC USES THEREOF CAPNS1, CAPN9, CAPN1 CAPN1 3/4885ACE 956/4885CTSB 105/4885

“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.

Send feedback