SCHEMBL470218

SCHEMBL470218

Cc1cc(Br)c(N2CCN(C(=O)OC(C)(C)C)CC2)cc1NC(=O)OC(C)(C)C

nearest known ligand 0.48

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
BACE1 P56817 5/20 0.48
LMNA P02545 4/20 0.47
MEN1 O00255 2/20 0.43
KMT2A Q03164 2/20 0.43
GPR119 Q8TDV5 2/20 0.41
MAPK8 P45983 1/20 0.41
MAPT P10636 3/20 0.41
KCNH2 Q12809 2/20 0.41
TSHR P16473 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
ALDH1A1 P00352 1/20 0.40
NAMPT P43490 1/20 0.40
NPSR1 Q6W5P4 1/20 0.40
F13A1 P00488 1/20 0.39
TGM2 P21980 1/20 0.39
TGM1 P22735 1/20 0.39

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
SCHEMBL29796094 1.00 BACE1 (0.48) BACE1LMNAMEN1KMT2AGPR119
SCHEMBL470229 0.89 MEN1 (0.46) BACE1LMNAMEN1KMT2AGPR119
SCHEMBL470227 0.87 BACE1 (0.47) BACE1LMNAMEN1KMT2AGPR119
SCHEMBL457432 0.86 MEN1 (0.51) BACE1LMNAMEN1KMT2AGPR119
SCHEMBL463132 0.83 BACE1 (0.49) BACE1LMNAMEN1KMT2AGPR119
SCHEMBL470212 0.81 MEN1 (0.51) BACE1LMNAMEN1KMT2AMAPK8
SCHEMBL457220 0.80 MAPT (0.52) LMNAMEN1KMT2AGPR119MAPT
SCHEMBL13622521 0.80 PRKDC (0.45) LMNAMEN1KMT2AMAPTTSHR
SCHEMBL470197 0.79 MEN1 (0.47) BACE1LMNAMEN1KMT2AGPR119
SCHEMBL28704626 0.78 LMNA (0.50) BACE1LMNAMEN1KMT2AMAPT

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
WO-2020247298-A2 1-PYRAZOLYL, 5-, 6- DISUBSTITUTED INDAZOLE DERIVATIVES AS LRRK2 INHIBITORS, PHARMACEUTICAL COMPOSITIONS, AND USES THEREOF MERCK SHARP & DOHME CORP. (US) 2020-12-10 WO disclosed
US-20160318865-A1 TRICYCLIC LACTAM DERIVATIVES AS 11-BETA HYDROXYSTEROID DEHYDROGENASE INHIBITORS JANSSEN PHARMACEUTICA NV (BE) 2016-11-03 US disclosed
WO-2012033736-A1 NOVEL PIPERAZINE ANALOGS AS BROAD-SPECTRUM INFLUENZA ANTIVIRALS BRISTOL-MYERS SQUIBB COMPANY (US) 2012-03-15 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-20160318865-A1 TRICYCLIC LACTAM DERIVATIVES AS 11-BETA HYDROXYSTEROID DEHYDROGENASE INHIBITORS HSD17B1, HSD17B11, HSD11B1 BACE1 272/4885LMNA 3306/4885MEN1 1783/4885

“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.