SCHEMBL22890216

SCHEMBL22890216

Cc1c(C(=O)O)nc(Cl)c(C#N)c1C

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.49
LRRK2 Q5S007 2/20 0.42
KDM4E B2RXH2 5/20 0.39
TDP1 Q9NUW8 2/20 0.38
L3MBTL1 Q9Y468 2/20 0.37
ALOX15 P16050 1/20 0.37
HSD17B10 Q99714 1/20 0.37
HCAR2 Q8TDS4 1/20 0.34
KMT2A Q03164 4/20 0.34
MEN1 O00255 3/20 0.34
GLA P06280 1/20 0.34
TSHR P16473 1/20 0.34
HTT P42858 1/20 0.34
GAA P10253 2/20 0.33
HPGD P15428 1/20 0.33
MAPK1 P28482 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
MAPT P10636 1/20 0.33
CACNA1B Q00975 1/20 0.33
APBA1 Q02410 1/20 0.33

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
SCHEMBL29741169 1.00 ALDH1A1 (0.49) ALDH1A1LRRK2KDM4ETDP1L3MBTL1
SCHEMBL22890311 0.88 ALDH1A1 (0.47) ALDH1A1LRRK2KDM4ETDP1L3MBTL1
SCHEMBL22889930 0.81 LRRK2 (0.43) ALDH1A1LRRK2KDM4ETDP1L3MBTL1
SCHEMBL22890816 0.81 ALDH1A1 (0.47) ALDH1A1LRRK2KDM4EL3MBTL1ALOX15
SCHEMBL22890418 0.79 KDM4E (0.39) ALDH1A1LRRK2KDM4EL3MBTL1ALOX15
SCHEMBL22889967 0.76 LRRK2 (0.46) ALDH1A1LRRK2KDM4ETDP1ALOX15
SCHEMBL22890491 0.75 LRRK2 (0.43) ALDH1A1LRRK2KDM4EL3MBTL1ALOX15
SCHEMBL22890765 0.75 HTT (0.40) ALDH1A1KDM4EL3MBTL1ALOX15HSD17B10
SCHEMBL22889980 0.75 KDM4E (0.37) ALDH1A1LRRK2KDM4EALOX15HSD17B10
SCHEMBL11822208 0.74 ALDH1A1 (0.61) ALDH1A1KDM4EL3MBTL1HSD17B10KMT2A

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 7 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
WO-2022155419-A1 INDAZOLES AND AZAINDAZOLES AS LRRK2 INHIBITORS ESCAPE Bio, Inc. (US) 2022-07-21 WO 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 ALDH1A1 1904/4885LRRK2 1/4885KDM4E 1401/4885
US-20230077268-A1 INDAZOLES AND AZAINDAZOLES AS LRRK2 INHIBITORS LRRK2, PARK7, GDI2 ALDH1A1 1904/4885LRRK2 1/4885KDM4E 1401/4885

“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.