SCHEMBL25844759

SCHEMBL25844759

COc1ccc(C2(c3ccc(N4CCOCC4)cc3)C=Cc3c4c(c5ccc(OC)cc5c3O2)-c2ccc(-c3ccc(C)cc3)cc2C4(C)C)cc1

nearest known ligand 0.33

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AKT1 P31749 1/20 0.33
PRKDC P78527 4/20 0.33
LRRK2 Q5S007 1/20 0.33
APP P05067 1/20 0.33
KMT2A Q03164 4/20 0.32
MAPT P10636 3/20 0.32
POLB P06746 1/20 0.32
TSHR P16473 1/20 0.32
MAPK1 P28482 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
HSD17B10 Q99714 1/20 0.32
MEN1 O00255 3/20 0.32
ADAM17 P78536 1/20 0.32
CHEK1 O14757 1/20 0.32
KDM4E B2RXH2 2/20 0.32
ALDH1A1 P00352 1/20 0.32
HTT P42858 1/20 0.32
RAB9A P51151 1/20 0.32
ALK Q9UM73 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.32

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
SCHEMBL25844767 0.97 MEN1 (0.35) AKT1PRKDCKMT2AMEN1CHEK1
SCHEMBL25607195 0.94 PRKDC (0.36) AKT1PRKDCAPPKMT2AMAPT
SCHEMBL25844700 0.94 ALK (0.34) PRKDCLRRK2KMT2AMAPTPOLB
SCHEMBL25844587 0.93 MEN1 (0.34) AKT1PRKDCKMT2AMAPTMEN1
SCHEMBL25607198 0.93 ALDH1A1 (0.35) AKT1PRKDCAPPKMT2AMAPT
SCHEMBL25844702 0.93 ALK (0.35) PRKDCLRRK2APPKMT2AMAPT
SCHEMBL25844763 0.93 ALDH1A1 (0.35) AKT1PRKDCAPPKMT2AMAPT
SCHEMBL30708906 0.92 RAB9A (0.35) PRKDCLRRK2APPKMT2AMAPT
SCHEMBL3700110 0.92 RAB9A (0.35) PRKDCLRRK2APPKMT2AMAPT
SCHEMBL18102198 0.92 PRKDC (0.36) AKT1PRKDCAPPKMT2AMAPT

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
US-20230227717-A1 PHOTOCHROMIC COMPOSITION, PHOTOCHROMIC ARTICLE, AND SPECTACLES HOYA LENS THAILAND LTD. (TH) 2023-07-20 US disclosed