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SCHEMBL25836113

SCHEMBL25836113

CO[Si](CCCNC(=O)C(F)(OC(F)(F)C(F)(OC(F)(F)C(F)(OC(F)(F)C(F)(OC(F)(F)C(F)(OC(F)(F)C(F)(F)C(F)(F)F)C(F)(F)F)C(F)(F)F)C(F)(F)F)C(F)(F)F)C(F)(F)F)(OC)OC

nearest known ligand 0.47

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 2/20 0.47
▸ POLB P06746 1/20 0.31
▸ SMN1; SMN2 Q16637 1/20 0.31
▸ MEN1 O00255 1/20 0.30
▸ KMT2A Q03164 1/20 0.30
▸ EPHX1 P07099 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
SCHEMBL30477976 1.00 ALDH1A1 (0.47) ALDH1A1POLBSMN1; SMN2MEN1KMT2A
SCHEMBL28969435 0.94 ALDH1A1 (0.52) ALDH1A1POLBSMN1; SMN2MEN1KMT2A
SCHEMBL3268319 0.88 ALDH1A1 (0.45) ALDH1A1EPHX1
SCHEMBL18814081 0.84 ALDH1A1 (0.43) ALDH1A1POLBSMN1; SMN2
SCHEMBL28969448 0.82 ALDH1A1 (0.51) ALDH1A1POLBSMN1; SMN2MEN1KMT2A
SCHEMBL28969436 0.81 ALDH1A1 (0.50) ALDH1A1POLBSMN1; SMN2MEN1KMT2A
SCHEMBL15357308 0.80 ALDH1A1 (0.49) ALDH1A1POLBSMN1; SMN2MEN1KMT2A
SCHEMBL29415505 0.80 ALDH1A1 (0.42) ALDH1A1POLBSMN1; SMN2MEN1KMT2A
SCHEMBL30392470 0.80 ALDH1A1 (0.42) ALDH1A1POLBSMN1; SMN2MEN1KMT2A
Iodide SCHEMBL28761621 0.78 ALDH1A1 (0.44) ALDH1A1EPHX1

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-20230219050-A1 Method For Preparing Raspberry Nanoparticles SURFACTIS TECHNOLOGIES (FR) 2023-07-13 — — US disclosed