SCHEMBL23782883

SCHEMBL23782883

Cc1cc2c(cc1Br)CCCC2=O

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.49
KMT2A Q03164 2/20 0.49
MAPK1 P28482 1/20 0.49
NPSR1 Q6W5P4 1/20 0.49
MAOA P21397 9/20 0.44
MAOB P27338 9/20 0.44
PRKCI P41743 1/20 0.44
CYP2A6 P11509 1/20 0.41
BAZ2B Q9UIF8 1/20 0.41
HSD17B1 P14061 2/20 0.40
BCHE P06276 1/20 0.40
CES1 P23141 1/20 0.40
POLB P06746 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
ALDH1A1 P00352 2/20 0.39
MAPT P10636 1/20 0.39
GRM5 P41594 1/20 0.38
PGR P06401 1/20 0.35
PABPC1 P11940 1/20 0.34
TSHR P16473 1/20 0.34

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
SCHEMBL15613957 0.89 BCHE (0.42) MEN1KMT2AMAPK1NPSR1HSD17B1
SCHEMBL8615975 0.84 MEN1 (0.55) MEN1KMT2AMAPK1NPSR1MAOA
SCHEMBL1275258 0.84 MEN1 (0.55) MEN1KMT2AMAPK1NPSR1MAOA
SCHEMBL10750496 0.81 MAPK1 (0.49) MEN1KMT2AMAPK1NPSR1MAOA
SCHEMBL30888583 0.81 PBRM1 (0.41) MEN1KMT2AMAPK1NPSR1HSD17B1
SCHEMBL4818430 0.81 PBRM1 (0.41) MEN1KMT2AMAPK1NPSR1HSD17B1
SCHEMBL10389430 0.80 MEN1 (0.50) MEN1KMT2AMAPK1NPSR1MAOA
SCHEMBL10389435 0.80 MEN1 (0.50) MEN1KMT2AMAPK1NPSR1MAOA
SCHEMBL28633834 0.79 HSD17B1 (0.50) MEN1KMT2AMAPK1NPSR1MAOA
SCHEMBL1027553 0.78 MAPK1 (0.49) MEN1KMT2AMAPK1NPSR1MAOA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230148214-A1 INDAZOLES AND AZAINDAZOLES AS LRRK2 INHIBITORS ESCAPE Bio, Inc. 2023-05-11 US disclosed
WO-2021178780-A1 INDAZOLES AND AZAINDAZOLES AS LRRK2 INHIBITORS ESCAPE Bio, Inc. (US) 2021-09-10 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-20230148214-A1 INDAZOLES AND AZAINDAZOLES AS LRRK2 INHIBITORS LRRK2, PARK7, GDI2 MEN1 2815/4885KMT2A 361/4885MAPK1 650/4885

“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.