SCHEMBL22896898

SCHEMBL22896898

Cc1noc(C(=O)NC(Cc2ccco2)C(=O)C(N)=O)c1-c1ccccn1

nearest known ligand 0.41

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ TSHR P16473 6/20 0.41
▸ SMN1; SMN2 Q16637 1/20 0.41
▸ CAPN1 P07384 12/20 0.39
▸ HSD17B10 Q99714 3/20 0.39
▸ USP2 O75604 2/20 0.39
▸ ALOX15 P16050 2/20 0.39
▸ ALDH1A1 P00352 2/20 0.38
▸ MAPT P10636 2/20 0.37
▸ KDM4E B2RXH2 1/20 0.37
▸ POLB P06746 1/20 0.37
▸ HPGD P15428 1/20 0.37
▸ HTT P42858 1/20 0.37
▸ MAPK1 P28482 2/20 0.36
▸ CTSS P25774 1/20 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
SCHEMBL22895948 0.87 CAPN1 (0.41) SMN1; SMN2CAPN1MAPK1CTSS
SCHEMBL22896406 0.87 CAPN1 (0.52) CAPN1CTSS
SCHEMBL22895934 0.85 CAPN1 (0.46) CAPN1CTSS
SCHEMBL22895846 0.84 CAPN1 (0.42) CAPN1CTSS
SCHEMBL22895857 0.83 USP30 (0.40) CAPN1CTSS
SCHEMBL22896419 0.83 CAPN1 (0.39) TSHRCAPN1HSD17B10USP2ALOX15
SCHEMBL22896432 0.83 CAPN1 (0.40) CAPN1CTSS
SCHEMBL22895918 0.83 CAPN1 (0.44) TSHRCAPN1CTSS
SCHEMBL22896305 0.83 CAPN1 (0.39) TSHRSMN1; SMN2CAPN1HSD17B10USP2
SCHEMBL22896913 0.82 CAPN1 (0.42) TSHRSMN1; SMN2CAPN1HSD17B10ALOX15

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 TSHR 4380/4885SMN1; SMN2 200/4885CAPN1 3/4885
US-10894776-B2 — CAPNS1, CAPN9, CAPN2 TSHR 4691/4885SMN1; SMN2 263/4885CAPN1 4/4885
US-11339130-B1 Calpain modulators and therapeutic uses thereof CAPNS1, CAPN9, CAPN1 TSHR 4380/4885SMN1; SMN2 200/4885CAPN1 3/4885

“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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