SCHEMBL22886595

SCHEMBL22886595

COC(=O)C(O)C(Cc1ccccc1)NC(=O)c1nsnc1-c1cccc2c1OC(F)(F)O2

nearest known ligand 0.39

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ PYGL P06737 2/20 0.39
▸ F2 P00734 1/20 0.34
▸ F10 P00742 1/20 0.34
▸ PRSS1 P07477 1/20 0.34
▸ REN P00797 3/20 0.33
▸ ADORA2A P29274 2/20 0.33
▸ ATM Q13315 1/20 0.32
▸ NPC1 O15118 1/20 0.32
▸ RAB9A P51151 1/20 0.32
▸ LTA4H P09960 1/20 0.32
▸ TRPM8 Q7Z2W7 1/20 0.32
▸ EGLN2 Q96KS0 2/20 0.32
▸ EGLN1 Q9GZT9 2/20 0.32
▸ KLK5 Q9Y337 1/20 0.31
▸ POLB P06746 1/20 0.31
▸ MAPT P10636 1/20 0.31
▸ TDP1 Q9NUW8 1/20 0.31
▸ CHRM4 P08173 1/20 0.31
▸ IDO1 P14902 1/20 0.31

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
SCHEMBL22886592 0.84 MAPT (0.35) ADORA2AATMNPC1RAB9APOLB
SCHEMBL22886593 0.82 CAPN1 (0.36) POLBMAPTTDP1
SCHEMBL22886428 0.80 PYGL (0.48) PYGLF2F10PRSS1ATM
SCHEMBL22886452 0.79 EPHX2 (0.42) PYGLF2F10PRSS1REN
SCHEMBL22886594 0.73 FFAR4 (0.39) ADORA2ARAB9AMAPT
SCHEMBL22886770 0.71 PYGL (0.38) PYGLF2F10PRSS1RAB9A
SCHEMBL22886598 0.70 ADORA2A (0.34) ADORA2ARAB9A
SCHEMBL22886430 0.69 PYGL (0.41) PYGLNPC1RAB9AEGLN2EGLN1
SCHEMBL22886609 0.69 PYGL (0.45) PYGLEGLN2EGLN1
SCHEMBL20028427 0.68 PYGL (0.41) PYGLF2F10PRSS1LTA4H

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 PYGL 719/4885F2 4704/4885F10 4138/4885

“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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