SCHEMBL22454075

SCHEMBL22454075

CC(C)(C)OC(=O)Nc1cc2c(-c3ccccc3)nn(C(=O)OC(C)(C)C)c2cc1F

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAP2K4 P45985 1/20 0.47
BRD9 Q9H8M2 1/20 0.45
CNR2 P34972 1/20 0.41
CYP17A1 P05093 1/20 0.40
BRD4 O60885 1/20 0.37
MAPT P10636 1/20 0.36
ACHE P22303 1/20 0.36
BACE1 P56817 1/20 0.36
RORC P51449 1/20 0.36
ACLY P53396 1/20 0.35
KMT2A Q03164 3/20 0.35
CKS1B P61024 2/20 0.35
SKP1 P63208 2/20 0.35
SKP2 Q13309 2/20 0.35
RXFP1 Q9HBX9 1/20 0.35
KDM4E B2RXH2 1/20 0.35
ALDH1A1 P00352 1/20 0.35
LMNA P02545 1/20 0.35
HPGD P15428 1/20 0.35
HTT P42858 1/20 0.35

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
SCHEMBL29664941 1.00 MAP2K4 (0.47) MAP2K4BRD9CNR2CYP17A1BRD4
SCHEMBL22445997 0.93 BRD9 (0.45) MAP2K4BRD9CNR2CYP17A1BRD4
SCHEMBL22445858 0.88 CNR2 (0.45) MAP2K4BRD9CNR2CYP17A1BRD4
SCHEMBL25994433 0.78 MAP2K4 (0.56) MAP2K4BRD9MAPTRORCKMT2A
SCHEMBL6370071 0.78 MAP2K4 (0.46) MAP2K4BRD9MAPTRORCACLY
SCHEMBL1513048 0.76 MAP2K4 (0.48) MAP2K4RORCKMT2ACKS1BSKP1
SCHEMBL6370428 0.76 MAP2K4 (0.47) MAP2K4MAPTACHEBACE1KMT2A
SCHEMBL6375165 0.75 PTGER1 (0.51) MAP2K4MAPTRORCKMT2ACKS1B
SCHEMBL6369573 0.75 MAP2K4 (0.51) MAP2K4BRD9MAPTRORCKMT2A
SCHEMBL6369557 0.75 MAP2K4 (0.50) MAP2K4RORCKMT2ACKS1BSKP1

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-20220162192-A1 INDAZOLES AS LRRK2 INHIBITORS ESCAPE Bio, Inc. 2022-05-26 US disclosed
US-20220162192-A1 INDAZOLES AS LRRK2 INHIBITORS ESCAPE Bio, Inc. 2022-05-26 US disclosed
WO-2020191261-A1 INDAZOLES AS LRRK2 INHIBITORS E-SCAPE BIO, INC. (US) 2020-09-24 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 (1 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-20220162192-A1 INDAZOLES AS LRRK2 INHIBITORS LRRK2, PARK7, PINK1 MAP2K4 951/4885BRD9 889/4885CNR2 1967/4885

“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.