SCHEMBL31073154

SCHEMBL31073154

C[C@H](O[Si](C)(C)C(C)(C)C)c1ccc(C=O)cc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TYR P14679 1/20 0.48
ALDH1A3 P47895 1/20 0.41
ALDH1A1 P00352 5/20 0.36
CYP2A6 P11509 3/20 0.36
ADRB2 P07550 1/20 0.34
ADRB1 P08588 1/20 0.34
ADRB3 P13945 1/20 0.34
GRIA4 P48058 1/20 0.33
AKR1C3 P42330 1/20 0.33
AKR1C2 P52895 1/20 0.33
NPSR1 Q6W5P4 1/20 0.33
KDM4E B2RXH2 2/20 0.32
CYP2A13 Q16696 1/20 0.32
BRD4 O60885 1/20 0.32
APLNR P35414 2/20 0.32
HSD17B10 Q99714 1/20 0.31
ALDH5A1 P51649 1/20 0.31
ABAT P80404 1/20 0.31
DRD1 P21728 1/20 0.31
LMNA P02545 1/20 0.31

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
SCHEMBL31073297 1.00 TYR (0.48) TYRALDH1A3ALDH1A1CYP2A6ADRB2
SCHEMBL8807193 1.00 TYR (0.48) TYRALDH1A3ALDH1A1CYP2A6ADRB2
SCHEMBL19812419 0.88 TYR (0.38) TYRALDH1A3ALDH1A1CYP2A6GRIA4
SCHEMBL9348331 0.83 ALDH1A1 (0.37) ALDH1A1
SCHEMBL10823122 0.82 TYR (0.55) TYRALDH1A3ALDH1A1CYP2A6GRIA4
SCHEMBL6124172 0.80 TYR (0.41) TYRALDH1A3ALDH1A1CYP2A6ADRB2
SCHEMBL2902173 0.78 KCNJ1 (0.31)
SCHEMBL19822824 0.78 TYR (0.31) TYRKDM4E
SCHEMBL20303038 0.78 PPARG (0.40) TYRALDH1A3ALDH1A1KDM4ELMNA
SCHEMBL1985326 0.78 ALDH1A3 (0.54) TYRALDH1A3ALDH1A1CYP2A6ADRB2

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-2024173646-A1 CYCLIN-DEPENDENT KINASE DEGRADING COMPOUNDS INNOVO THERAPEUTICS, INC. (US) 2024-08-22 WO disclosed