SCHEMBL22897296

SCHEMBL22897296

NC(=O)C(=O)[C@H](CCc1ccccc1)NC(=O)c1scnc1-c1ccccc1

nearest known ligand 0.45

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ CAPN1 P07384 15/20 0.45
▸ HPGD P15428 1/20 0.40
▸ KDR P35968 1/20 0.39
▸ KLKB1 P03952 1/20 0.38
▸ KLK1 P06870 1/20 0.38
▸ CNR1 P21554 1/20 0.38
▸ CTSS P25774 1/20 0.38

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
SCHEMBL20027687 0.89 CAPN1 (0.56) CAPN1CTSS
SCHEMBL30133616 0.89 CAPN1 (0.56) CAPN1CTSS
SCHEMBL22896995 0.89 CAPN1 (0.46) CAPN1CTSS
SCHEMBL22896245 0.84 CAPN1 (0.56) CAPN1CTSS
SCHEMBL22897170 0.80 CAPN1 (0.55) CAPN1CTSS
SCHEMBL22896884 0.79 CAPN1 (0.58) CAPN1CTSS
SCHEMBL20028067 0.79 CAPN1 (0.41) CAPN1HPGDCNR1CTSS
SCHEMBL22897063 0.78 CAPN1 (0.40) CAPN1CTSS
SCHEMBL20027676 0.78 CAPN1 (0.56) CAPN1CTSS
SCHEMBL21854115 0.78 CAPN1 (0.56) CAPN1CTSS

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10934261-B2 Calpain modulators and therapeutic uses thereof BLADE THERAPEUTICS, INC. (US) 2021-03-02 — — US disclosed
US-10894776-B2 — — 2021-01-19 — — 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 (2 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-10934261-B2 Calpain modulators and therapeutic uses thereof CAPNS1, CAPN9, CAPN1 CAPN1 3/4885HPGD 2346/4885KDR 4332/4885
US-10894776-B2 — CAPNS1, CAPN9, CAPN2 CAPN1 4/4885HPGD 2414/4885KDR 4651/4885

“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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