SCHEMBL22896504

SCHEMBL22896504

Cc1noc(C(=O)NC(Cc2csc3ccccc23)C(=O)C(N)=O)c1-c1ccccn1

nearest known ligand 0.43

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ F10 P00742 2/20 0.43
▸ CAPN1 P07384 12/20 0.40
▸ TACR1 P25103 1/20 0.38
▸ MMP2 P08253 1/20 0.37
▸ MMP9 P14780 1/20 0.37
▸ MMP8 P22894 1/20 0.37
▸ CTSL P07711 1/20 0.37
▸ CTSS P25774 1/20 0.37
▸ CTSK P43235 1/20 0.37
▸ L3MBTL1 Q9Y468 1/20 0.36
▸ KLKB1 P03952 2/20 0.36
▸ KLK1 P06870 2/20 0.36

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
SCHEMBL22897072 0.84 F10 (0.43) F10CAPN1TACR1MMP2MMP9
SCHEMBL22895913 0.84 F10 (0.41) F10CAPN1TACR1MMP2MMP9
SCHEMBL22896467 0.84 CAPN1 (0.44) CAPN1
SCHEMBL22896411 0.84 F10 (0.41) F10CAPN1TACR1MMP2MMP9
SCHEMBL22895857 0.84 USP30 (0.40) CAPN1CTSS
SCHEMBL22896453 0.84 ITGB2 (0.47) CAPN1TACR1MMP2CTSL
SCHEMBL22896406 0.84 CAPN1 (0.52) CAPN1CTSS
SCHEMBL22895948 0.84 CAPN1 (0.41) CAPN1CTSSCTSK
SCHEMBL22896707 0.83 F10 (0.43) F10CAPN1TACR1MMP2MMP9
SCHEMBL22897071 0.83 F10 (0.43) F10CAPN1TACR1MMP2MMP9

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 F10 4552/4885CAPN1 3/4885TACR1 3588/4885
US-10894776-B2 — CAPNS1, CAPN9, CAPN2 F10 4424/4885CAPN1 4/4885TACR1 3899/4885
US-11339130-B1 Calpain modulators and therapeutic uses thereof CAPNS1, CAPN9, CAPN1 F10 4552/4885CAPN1 3/4885TACR1 3588/4885

“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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