SCHEMBL20028202

SCHEMBL20028202

COC(=O)c1cc(C)nn1-c1ccc(CNC(C)=O)cc1

nearest known ligand 0.55

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
MAPT P10636 5/20 0.55
TP53 P04637 2/20 0.51
HPGD P15428 2/20 0.51
ALDH1A1 P00352 4/20 0.47
GRIA2 P42262 1/20 0.45
TSHR P16473 1/20 0.44
L3MBTL1 Q9Y468 3/20 0.43
TDP1 Q9NUW8 1/20 0.43
RAB9A P51151 2/20 0.42
POLB P06746 1/20 0.42
GAA P10253 1/20 0.41
KMT2A Q03164 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
SCHEMBL20028525 0.90 MAPT (0.55) MAPTTP53HPGDALDH1A1TSHR
SCHEMBL20028203 0.87 MAPT (0.60) MAPTTP53HPGDALDH1A1GRIA2
SCHEMBL20027618 0.87 MAPT (0.52) MAPTTP53HPGDALDH1A1TSHR
SCHEMBL20028140 0.85 MAPT (0.64) MAPTTP53HPGDALDH1A1L3MBTL1
SCHEMBL22896858 0.85 MAPT (0.50) MAPTTP53HPGDALDH1A1L3MBTL1
SCHEMBL20028059 0.84 MAPT (0.57) MAPTTP53HPGDALDH1A1L3MBTL1
SCHEMBL22897175 0.83 LOXL2 (0.49) MAPTALDH1A1L3MBTL1TDP1RAB9A
SCHEMBL22896512 0.82 MAPT (0.55) MAPTTP53HPGDALDH1A1L3MBTL1
SCHEMBL22896939 0.82 MAPT (0.55) MAPTTP53HPGDALDH1A1L3MBTL1
SCHEMBL20028526 0.80 MAPT (0.58) MAPTTP53HPGDALDH1A1TSHR

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 MAPT 562/4885TP53 1804/4885HPGD 2346/4885
US-10894776-B2 CAPNS1, CAPN9, CAPN2 MAPT 330/4885TP53 1368/4885HPGD 2414/4885
US-11339130-B1 Calpain modulators and therapeutic uses thereof CAPNS1, CAPN9, CAPN1 MAPT 562/4885TP53 1804/4885HPGD 2346/4885

“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.