SCHEMBL24404152

SCHEMBL24404152

COc1ccc2c(c1)C1(CCC3(CCCCCC3)CC1)c1c3c(c4cc(OC)ccc4c1-2)OC(c1ccc(O)cc1)(c1ccc(N2CCOCC2)cc1)C=C3

nearest known ligand 0.32

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ATM Q13315 1/20 0.32
MAPT P10636 3/20 0.31
POLB P06746 1/20 0.31
TSHR P16473 1/20 0.31
MAPK1 P28482 1/20 0.31
KMT2A Q03164 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
HSD17B10 Q99714 1/20 0.31
ADAM17 P78536 1/20 0.31
KDM4E B2RXH2 1/20 0.30
ALDH1A1 P00352 1/20 0.30
HTT P42858 1/20 0.30
L3MBTL1 Q9Y468 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
SCHEMBL22864324 0.91 ATM (0.34) ATMMAPTPOLBTSHRMAPK1
SCHEMBL24604951 0.91 MAPT (0.33) ATMMAPTPOLBADAM17
SCHEMBL24404153 0.88 MAPT (0.34) MAPTALDH1A1L3MBTL1
SCHEMBL25696887 0.87 ATM (0.34) ATMMAPTPOLBTSHRMAPK1
SCHEMBL22864323 0.87 ADAM17 (0.32) ATMMAPTPOLBTSHRMAPK1
SCHEMBL24605038 0.86 MAPT (0.33) MAPT
SCHEMBL24605273 0.86 AKT1 (0.34) ATMMAPTPOLBTSHRMAPK1
SCHEMBL26032649 0.86 AKT1 (0.34) ATMMAPTPOLBTSHRMAPK1
SCHEMBL10102398 0.85 MAPT (0.34) ATMMAPTPOLBTSHRMAPK1
SCHEMBL15765701 0.84 MAPT (0.33) ATMMAPTPOLBTSHRMAPK1

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
EP-3995493-A1 CHROMENE COMPOUND AND PHOTOCHROMIC OPTICAL ARTICLE Tokuyama Corporation (JP) 2022-05-11 EP disclosed