SCHEMBL22890214

SCHEMBL22890214

CCOC(=O)c1cc(C#N)c(=O)n(C)c1C

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 14/20 0.52
ALDH1A1 P00352 10/20 0.52
MAPT P10636 6/20 0.52
KMT2A Q03164 5/20 0.52
MEN1 O00255 4/20 0.52
HSD17B10 Q99714 4/20 0.52
RXFP1 Q9HBX9 1/20 0.52
L3MBTL1 Q9Y468 5/20 0.51
GAA P10253 3/20 0.50
HPGD P15428 3/20 0.47
POLB P06746 3/20 0.47
LMNA P02545 2/20 0.47
GLA P06280 1/20 0.47
ATM Q13315 1/20 0.47
NPSR1 Q6W5P4 1/20 0.46
TDP1 Q9NUW8 2/20 0.46
HTT P42858 1/20 0.43
RECQL P46063 1/20 0.43
TP53 P04637 1/20 0.43
ALOX15 P16050 1/20 0.43

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
SCHEMBL22890556 0.80 L3MBTL1 (0.50) KDM4EALDH1A1MAPTKMT2AMEN1
SCHEMBL1220842 0.80 ALDH1A1 (0.52) KDM4EALDH1A1MAPTKMT2AHSD17B10
SCHEMBL28984043 0.75 TSHR (0.47) KDM4EALDH1A1MAPTKMT2AMEN1
SCHEMBL11359782 0.75 TSHR (0.56) KDM4EALDH1A1MAPTKMT2AMEN1
SCHEMBL4110150 0.75 L3MBTL1 (0.49) KDM4EALDH1A1MAPTKMT2AMEN1
SCHEMBL6624145 0.74 KDM4E (0.57) KDM4EALDH1A1MAPTKMT2AMEN1
SCHEMBL21318015 0.74 KDM4E (0.58) KDM4EALDH1A1MAPTKMT2AMEN1
SCHEMBL19377630 0.74 ALDH1A1 (0.53) KDM4EALDH1A1MAPTKMT2AMEN1
SCHEMBL3227136 0.72 MAPT (0.72) KDM4EALDH1A1MAPTKMT2AMEN1
SCHEMBL3092655 0.72 ALDH1A1 (0.56) KDM4EALDH1A1MAPTKMT2AMEN1

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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230077268-A1 INDAZOLES AND AZAINDAZOLES AS LRRK2 INHIBITORS E-SCAPE BIO, INC. 2023-03-09 US disclosed
US-11427558-B1 Indazoles and azaindazoles as LRRK2 inhibitors ESCAPE Bio, Inc. (US) 2022-08-30 US disclosed
EP-3997081-A1 INDAZOLES AND AZAINDAZOLES AS LRRK2 INHIBITORS Escape Bio, Inc. (US) 2022-05-18 EP disclosed
CN-114450274-A Indazoles and azaindazoles as LRRK2 inhibitors 伊斯凯普生物公司 2022-05-06 CN disclosed
WO-2021007477-A1 INDAZOLES AND AZAINDAZOLES AS LRRK2 INHIBITORS E-SCAPE BIO, INC. (US) 2021-01-14 WO disclosed
WO-2021007477-A1 INDAZOLES AND AZAINDAZOLES AS LRRK2 INHIBITORS E-SCAPE BIO, INC. (US) 2021-01-14 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 (2 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-11427558-B1 Indazoles and azaindazoles as LRRK2 inhibitors LRRK2, PARK7, GDI2 KDM4E 1401/4885ALDH1A1 1904/4885MAPT 66/4885
US-20230077268-A1 INDAZOLES AND AZAINDAZOLES AS LRRK2 INHIBITORS LRRK2, PARK7, GDI2 KDM4E 1401/4885ALDH1A1 1904/4885MAPT 66/4885

“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.