SCHEMBL22897256

SCHEMBL22897256

CCOC(=O)c1cc(C)nn1-c1cccc(CNC(=O)OC)c1

nearest known ligand 0.50

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 1/20 0.50
SMN1; SMN2 Q16637 2/20 0.47
MAPT P10636 3/20 0.47
L3MBTL1 Q9Y468 2/20 0.45
ALDH1A1 P00352 4/20 0.45
TP53 P04637 1/20 0.43
MAPK14 Q16539 1/20 0.42
CARM1 Q86X55 2/20 0.42
SCN9A Q15858 1/20 0.42
LMNA P02545 1/20 0.42
STAT1 P42224 1/20 0.42
TSHR P16473 1/20 0.42
POLB P06746 1/20 0.41

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
SCHEMBL20028694 0.94 KMT2A (0.51) KMT2ASMN1; SMN2MAPTL3MBTL1ALDH1A1
SCHEMBL20028491 0.90 KMT2A (0.51) KMT2ASMN1; SMN2MAPTL3MBTL1ALDH1A1
SCHEMBL18231857 0.90 KMT2A (0.47) KMT2ASMN1; SMN2MAPTL3MBTL1ALDH1A1
SCHEMBL29641667 0.90 KMT2A (0.47) KMT2ASMN1; SMN2MAPTL3MBTL1ALDH1A1
SCHEMBL20027768 0.88 MAPT (0.52) KMT2AMAPTL3MBTL1ALDH1A1TP53
SCHEMBL20028050 0.86 KMT2A (0.52) KMT2ASMN1; SMN2MAPTL3MBTL1ALDH1A1
SCHEMBL20028524 0.86 KMT2A (0.60) KMT2AMAPTL3MBTL1ALDH1A1MAPK14
SCHEMBL22897252 0.86 MAPT (0.50) KMT2ASMN1; SMN2MAPTL3MBTL1ALDH1A1
SCHEMBL20027787 0.85 KMT2A (0.51) KMT2ASMN1; SMN2MAPTL3MBTL1ALDH1A1
SCHEMBL20028223 0.84 KMT2A (0.53) KMT2ASMN1; SMN2MAPTL3MBTL1ALDH1A1

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 KMT2A 4418/4885SMN1; SMN2 200/4885MAPT 562/4885
US-10894776-B2 CAPNS1, CAPN9, CAPN2 KMT2A 4469/4885SMN1; SMN2 263/4885MAPT 330/4885
US-11339130-B1 Calpain modulators and therapeutic uses thereof CAPNS1, CAPN9, CAPN1 KMT2A 4418/4885SMN1; SMN2 200/4885MAPT 562/4885

“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.