SCHEMBL23720530

SCHEMBL23720530

OCCOCCOCCOCCOCCOCCOc1ccc(Br)cn1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
APP P05067 8/20 0.40
MAPT P10636 1/20 0.40
SNCA P37840 1/20 0.40
KDM4E B2RXH2 2/20 0.39
LSS P48449 2/20 0.38
MEN1 O00255 2/20 0.38
KMT2A Q03164 2/20 0.38
L3MBTL1 Q9Y468 1/20 0.36
PIK3CD O00329 1/20 0.36
PIK3CA P42336 1/20 0.36
PIK3CB P42338 1/20 0.36
PI4KA P42356 1/20 0.36
PIK3CG P48736 1/20 0.36
PI4KB Q9UBF8 1/20 0.36
GABRA5 P31644 1/20 0.35
MAPK1 P28482 2/20 0.35
ALDH1A1 P00352 2/20 0.35
USP2 O75604 1/20 0.35
LMNA P02545 1/20 0.35
CYP3A4 P08684 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
SCHEMBL20120474 1.00 APP (0.40) APPMAPTSNCAKDM4ELSS
SCHEMBL14211685 1.00 APP (0.40) APPMAPTSNCAKDM4ELSS
SCHEMBL23720528 0.95 LSS (0.41) APPMAPTSNCAKDM4ELSS
SCHEMBL23720518 0.95 LSS (0.41) APPMAPTSNCAKDM4ELSS
SCHEMBL23720314 0.95 LSS (0.41) APPMAPTSNCAKDM4ELSS
SCHEMBL23720320 0.90 APP (0.38) APPMAPTSNCAKDM4ELSS
SCHEMBL1284075 0.89 KDM4E (0.42) APPMAPTKDM4ELSSKMT2A
SCHEMBL23720524 0.89 LSS (0.39) APPMAPTSNCAKDM4ELSS
SCHEMBL23720493 0.89 LSS (0.39) APPMAPTSNCAKDM4ELSS
SCHEMBL23720315 0.89 LSS (0.39) APPMAPTSNCAKDM4ELSS

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2021155006-A1 INHIBITORS OF CYCLIN-DEPENDENT KINASES AND USES THEREOF LES LABORATOIRES SERVIER SAS (FR) 2021-08-05 WO disclosed