SCHEMBL29961323

SCHEMBL29961323

Cn1cc(C(=O)NC(Cc2ccccc2)C(=O)C(=O)O)c(-c2ccccc2F)n1

nearest known ligand 0.45

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ CTSL P07711 3/20 0.44
▸ DCAF1 Q9Y4B6 1/20 0.43
▸ CTSV O60911 1/20 0.42
▸ CTSS P25774 1/20 0.42
▸ CTSK P43235 1/20 0.42
▸ PSMB5 P28074 3/20 0.41
▸ CAPN1 P07384 9/20 0.41
▸ POLB P06746 1/20 0.41
▸ MEN1 O00255 1/20 0.40
▸ KMT2A Q03164 1/20 0.40
▸ CNR1 P21554 1/20 0.39
▸ CNR2 P34972 1/20 0.39

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
SCHEMBL21410955 1.00 CTSL (0.44) CTSLDCAF1CTSVCTSSCTSK
SCHEMBL21854245 0.92 CAPN1 (0.51) DCAF1CTSSCAPN1
SCHEMBL20027555 0.92 CAPN1 (0.51) DCAF1CTSSCAPN1
SCHEMBL22885972 0.91 CTSL (0.42) CTSLDCAF1CTSVCTSSCTSK
SCHEMBL22886525 0.89 CAPN1 (0.41) CTSLCTSSPSMB5CAPN1
SCHEMBL22886498 0.88 L3MBTL1 (0.46) CTSLDCAF1CTSVCTSSCTSK
SCHEMBL22886500 0.87 DCAF1 (0.54) CTSLDCAF1CTSVCTSSCTSK
SCHEMBL22885813 0.86 CAPN1 (0.40) CTSSPSMB5CAPN1
SCHEMBL22886747 0.85 CAPN1 (0.49) CTSLDCAF1CTSVCTSSCTSK
SCHEMBL20027556 0.85 CAPN1 (0.48) DCAF1CTSSPSMB5CAPN1

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-20220347173-A1 METHODS OF TREATING LIVER FIBROSIS USING CALPAIN INHIBITORS BLADE THERAPEUTICS INC (US) 2022-11-03 — — 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-20220347173-A1 METHODS OF TREATING LIVER FIBROSIS USING CALPAIN INHIBITORS CAPNS1, CAPN9, CAPN2 CTSL 54/4885DCAF1 3032/4885CTSV 85/4885

“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