SCHEMBL22897149

SCHEMBL22897149

NC(=O)C(=O)C(Cc1ccccn1)NC(=O)c1nscc1-c1ccccn1

nearest known ligand 0.44

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ CAPN1 P07384 11/20 0.42
▸ KDM4E B2RXH2 1/20 0.38
▸ MAPK10 P53779 1/20 0.38
▸ HSD17B10 Q99714 1/20 0.38
▸ CTSS P25774 2/20 0.38
▸ LMNA P02545 1/20 0.38
▸ HTT P42858 1/20 0.38
▸ CTSK P43235 1/20 0.38
▸ HDAC6 Q9UBN7 3/20 0.37
▸ HDAC1 Q13547 2/20 0.37
▸ KMT2A Q03164 1/20 0.37

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
SCHEMBL22897005 0.90 CAPN1 (0.53) CAPN1CTSS
SCHEMBL22897038 0.88 CAPN1 (0.47) CAPN1CTSS
SCHEMBL22897151 0.86 CAPN1 (0.42) CAPN1CTSS
SCHEMBL22896565 0.86 USP30 (0.42) CAPN1CTSSLMNAKMT2A
SCHEMBL22896806 0.86 CAPN1 (0.44) CAPN1CTSS
SCHEMBL22896683 0.85 CAPN1 (0.43) CAPN1CTSS
SCHEMBL22896755 0.85 CAPN1 (0.41) CAPN1KDM4EHSD17B10CTSSLMNA
SCHEMBL22896786 0.85 CAPN1 (0.47) CAPN1CTSS
SCHEMBL22896673 0.84 CAPN1 (0.49) CAPN1CTSSCTSK
SCHEMBL22896177 0.84 CTSS (0.40) CAPN1CTSSCTSKHDAC6HDAC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11339130-B1 Calpain modulators and therapeutic uses thereof BLADE THERAPEUTICS, INC. (US) 2022-05-24 — — US disclosed
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 (3 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 3/4885KDM4E 3495/4885MAPK10 2162/4885
US-10894776-B2 — CAPNS1, CAPN9, CAPN2 CAPN1 4/4885KDM4E 3117/4885MAPK10 1749/4885
US-11339130-B1 Calpain modulators and therapeutic uses thereof CAPNS1, CAPN9, CAPN1 CAPN1 3/4885KDM4E 3495/4885MAPK10 2162/4885

“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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