SCHEMBL22897034

SCHEMBL22897034

Cc1onc(-c2ccco2)c1C(=O)NC(Cc1ccccc1)C(=O)C(N)=O

nearest known ligand 0.49

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ CAPN1 P07384 7/20 0.49
▸ TSHR P16473 2/20 0.48
▸ PTGS1 P23219 1/20 0.44
▸ PTGS2 P35354 1/20 0.44
▸ L3MBTL1 Q9Y468 2/20 0.44
▸ ITGB1 P05556 1/20 0.44
▸ ITGA4 P13612 1/20 0.44
▸ KMT2A Q03164 2/20 0.43
▸ ALDH1A1 P00352 2/20 0.43
▸ CTSL P07711 1/20 0.42
▸ GAA P10253 2/20 0.42
▸ MEN1 O00255 1/20 0.42
▸ GABRA5 P31644 1/20 0.42

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
SCHEMBL22896355 0.88 L3MBTL1 (0.56) CAPN1TSHRL3MBTL1KMT2AALDH1A1
SCHEMBL30133620 0.88 L3MBTL1 (0.56) CAPN1TSHRL3MBTL1KMT2AALDH1A1
SCHEMBL22896718 0.84 ALDH1A1 (0.52) CAPN1TSHRL3MBTL1ITGB1ITGA4
SCHEMBL22897259 0.83 L3MBTL1 (0.48) CAPN1TSHRL3MBTL1KMT2AALDH1A1
SCHEMBL22897241 0.83 SMN1; SMN2 (0.57) CAPN1TSHRL3MBTL1KMT2AALDH1A1
SCHEMBL22897186 0.82 CAPN1 (0.51) CAPN1
SCHEMBL22897262 0.82 ALDH1A1 (0.60) CAPN1L3MBTL1KMT2AALDH1A1GAA
SCHEMBL22897206 0.82 HPGDS (0.50) CAPN1L3MBTL1KMT2AALDH1A1CTSL
SCHEMBL22896340 0.82 CAPN1 (0.48) CAPN1L3MBTL1ITGB1ITGA4KMT2A
SCHEMBL22896801 0.81 CAPN1 (0.48) CAPN1TSHRL3MBTL1KMT2AALDH1A1

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 3/4885TSHR 4380/4885PTGS1 1583/4885
US-10894776-B2 — CAPNS1, CAPN9, CAPN2 CAPN1 4/4885TSHR 4691/4885PTGS1 1823/4885
US-11339130-B1 Calpain modulators and therapeutic uses thereof CAPNS1, CAPN9, CAPN1 CAPN1 3/4885TSHR 4380/4885PTGS1 1583/4885

“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.

Send feedback