SCHEMBL25844142

SCHEMBL25844142

CSc1ccc(C2(c3ccc(N4CCOCC4)cc3)C=Cc3c4c(c5ccccc5c3O2)-c2ccc(C)cc2C4(C)C)cc1

nearest known ligand 0.33

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
ALK Q9UM73 1/20 0.33
MAPT P10636 3/20 0.31
MEN1 O00255 2/20 0.31
KMT2A Q03164 2/20 0.31
LMNA P02545 1/20 0.31
KDM4E B2RXH2 2/20 0.30
ALDH1A1 P00352 1/20 0.30
SMN1; SMN2 Q16637 1/20 0.30
HSD17B10 Q99714 1/20 0.30

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
SCHEMBL25844147 0.94 ALK (0.36) ALKMAPTMEN1KMT2ALMNA
SCHEMBL25844146 0.93 MAPT (0.35) ALKMAPTMEN1KMT2ALMNA
SCHEMBL25844138 0.93 MAPT (0.35) ALKMAPTMEN1KMT2ALMNA
SCHEMBL25604436 0.91 PDK2 (0.31) MAPTMEN1KMT2AKDM4E
SCHEMBL25844150 0.91 SLC6A2 (0.35) ALKMAPTMEN1KMT2ALMNA
SCHEMBL25844127 0.91 MAPT (0.35) ALKMAPTMEN1KMT2ALMNA
SCHEMBL25844019 0.90
SCHEMBL25713928 0.90 PDK2 (0.33) MAPTMEN1KMT2AKDM4EALDH1A1
SCHEMBL25714659 0.89 ALK (0.42) ALK
SCHEMBL25844116 0.89 PDK2 (0.34) ALKMAPTMEN1KMT2ALMNA

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