SCHEMBL25844119

SCHEMBL25844119

Cc1ccc2c(c1)C(C)(C)c1c3c(c4ccccc4c1-2)OC(c1ccc(N2CCOCC2)cc1)(c1cc2ccccc2c2ccccc12)C=C3

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALK Q9UM73 1/20 0.34
MAPT P10636 3/20 0.33
LMNA P02545 2/20 0.33
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33
PIK3CD O00329 2/20 0.31
PIK3CA P42336 2/20 0.31
PIK3CB P42338 2/20 0.31
KDM4E B2RXH2 3/20 0.30
ALDH1A1 P00352 3/20 0.30
PDK2 Q15119 1/20 0.30
AHR P35869 1/20 0.30
HPGD P15428 1/20 0.30
MAPK1 P28482 1/20 0.30
TDP1 Q9NUW8 1/20 0.30
L3MBTL1 Q9Y468 1/20 0.30
PIK3CG P48736 1/20 0.30
SMN1; SMN2 Q16637 1/20 0.30
HSD17B10 Q99714 1/20 0.30
NPC1 O15118 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
SCHEMBL25844085 0.95 ALK (0.31) ALK
SCHEMBL25715957 0.92 PDK2 (0.34) MAPTPIK3CDPIK3CAPIK3CBKDM4E
SCHEMBL25844147 0.92 ALK (0.36) ALKMAPTLMNAMEN1KMT2A
SCHEMBL25844124 0.92 ALK (0.34) ALKMAPTLMNAMEN1KMT2A
SCHEMBL25844125 0.91 MAPT (0.33) ALKMAPTLMNAMEN1KMT2A
SCHEMBL25844138 0.90 MAPT (0.35) ALKMAPTLMNAMEN1KMT2A
SCHEMBL25601558 0.90 PDK2 (0.34) ALKMAPTPIK3CAALDH1A1PDK2
SCHEMBL25602252 0.90 ALK (0.42) ALKPIK3CA
SCHEMBL25844115 0.90 ALK (0.33) ALKMAPTLMNAMEN1KMT2A
SCHEMBL25844130 0.89 MEN1 (0.33) ALKMAPTLMNAMEN1KMT2A

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