SCHEMBL20027617

SCHEMBL20027617

Cc1cccc(-c2nn(C)cc2C(=O)NC(Cc2ccccc2)C(O)C(N)=O)n1

nearest known ligand 0.43

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ PYGL P06737 8/20 0.43
▸ DCAF1 Q9Y4B6 1/20 0.42
▸ TGFBR1 P36897 4/20 0.40
▸ CTSV O60911 1/20 0.38
▸ CTSL P07711 1/20 0.38
▸ CTSS P25774 1/20 0.38
▸ CTSK P43235 1/20 0.38
▸ IRAK4 Q9NWZ3 1/20 0.37
▸ CNR1 P21554 3/20 0.37
▸ CNR2 P34972 3/20 0.37
▸ CCR1 P32246 2/20 0.37
▸ MAPK14 Q16539 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
SCHEMBL21854280 0.85 CAPN1 (0.52) DCAF1CTSS
SCHEMBL22897214 0.83 DCAF1 (0.51) PYGLDCAF1CTSVCTSLCTSS
SCHEMBL22885966 0.82 CTSV (0.48) PYGLDCAF1CTSVCTSLCTSS
SCHEMBL22896923 0.82 PYGL (0.41) PYGLDCAF1CTSLCNR1CNR2
SCHEMBL20027817 0.82 PYGL (0.41) PYGLDCAF1CTSLCNR1CNR2
SCHEMBL20027914 0.80 DCAF1 (0.48) PYGLDCAF1
SCHEMBL20028606 0.80 PYGL (0.43) PYGLDCAF1CTSLCNR1CNR2
SCHEMBL20028717 0.80 DCAF1 (0.50) PYGLDCAF1CTSVCTSLCTSS
SCHEMBL20027619 0.79 PYGL (0.44) PYGLDCAF1CTSVCTSLCTSS
SCHEMBL22886468 0.79 PYGL (0.44) PYGLDCAF1CTSVCTSLCTSS

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 4 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
WO-2018064119-A1 CALPAIN MODULATORS AND THERAPEUTIC USES THEREOF BLADE THERAPEUTICS, INC. (US) 2018-04-05 — — WO 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 PYGL 925/4885DCAF1 3091/4885TGFBR1 4117/4885
US-10894776-B2 — CAPNS1, CAPN9, CAPN2 PYGL 668/4885DCAF1 3598/4885TGFBR1 4021/4885
US-11339130-B1 Calpain modulators and therapeutic uses thereof CAPNS1, CAPN9, CAPN1 PYGL 925/4885DCAF1 3091/4885TGFBR1 4117/4885

“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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