SCHEMBL22886500

SCHEMBL22886500

Cn1cc(C(=O)NC(Cc2ccccc2)C(=O)C(=O)O)c(-c2ccccc2)n1

nearest known ligand 0.54

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ DCAF1 Q9Y4B6 1/20 0.54
▸ CTSV O60911 1/20 0.48
▸ CTSL P07711 1/20 0.48
▸ CTSS P25774 1/20 0.48
▸ CTSK P43235 1/20 0.48
▸ CAPN1 P07384 15/20 0.47
▸ KLKB1 P03952 1/20 0.43
▸ KLK1 P06870 1/20 0.43
▸ CNR1 P21554 1/20 0.43
▸ CNR2 P34972 1/20 0.43

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
SCHEMBL22886747 0.94 CAPN1 (0.49) DCAF1CTSVCTSLCTSSCTSK
SCHEMBL22885939 0.92 DCAF1 (0.50) DCAF1CTSVCTSLCTSSCTSK
SCHEMBL23268990 0.91 CAPN1 (0.59) DCAF1CTSSCAPN1
SCHEMBL20028632 0.91 CAPN1 (0.59) DCAF1CTSSCAPN1
SCHEMBL22886415 0.90 DCAF1 (0.52) DCAF1CTSVCTSLCTSSCTSK
SCHEMBL22886629 0.90 DCAF1 (0.50) DCAF1CTSVCTSLCTSSCTSK
SCHEMBL22886498 0.88 L3MBTL1 (0.46) DCAF1CTSVCTSLCTSSCTSK
SCHEMBL22886521 0.87 CAPN1 (0.48) CAPN1
SCHEMBL21410955 0.87 CTSL (0.44) DCAF1CTSVCTSLCTSSCTSK
SCHEMBL29961323 0.87 CTSL (0.44) DCAF1CTSVCTSLCTSSCTSK

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-20210009564-A1 CALPAIN MODULATORS AND THERAPEUTIC USES THEREOF BLADE THERAPERTICS INC (US) 2021-01-14 — — 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-20210009564-A1 CALPAIN MODULATORS AND THERAPEUTIC USES THEREOF CAPNS1, CAPN9, CAPN1 DCAF1 2355/4885CTSV 159/4885CTSL 257/4885

“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.

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