SCHEMBL31430719

SCHEMBL31430719

CCN(CC)c1ccc2c(c1)[Si]1(CCCCC1)c1cc(N(CC)CC)ccc1C21OC(=O)c2cc(OC)c(C(=O)O)cc21

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 7/20 0.36
▸ MAPT P10636 2/20 0.36
▸ NPSR1 Q6W5P4 2/20 0.36
▸ GAA P10253 1/20 0.36
▸ HTT P42858 1/20 0.36
▸ HPGD P15428 3/20 0.34
▸ SMN1; SMN2 Q16637 2/20 0.34
▸ KDM4E B2RXH2 2/20 0.34
▸ HSD17B10 Q99714 2/20 0.34
▸ SLC16A3 O15427 1/20 0.34
▸ ALOX15 P16050 1/20 0.34
▸ SLC16A1 P53985 1/20 0.34
▸ MAPK1 P28482 1/20 0.34
▸ GFER P55789 1/20 0.34
▸ TSHR P16473 2/20 0.33
▸ L3MBTL1 Q9Y468 2/20 0.33
▸ MEN1 O00255 2/20 0.33
▸ KMT2A Q03164 2/20 0.33
▸ CES2 O00748 1/20 0.33
▸ RXRA P19793 2/20 0.32

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
SCHEMBL23753346 1.00 ALDH1A1 (0.36) ALDH1A1MAPTNPSR1GAAHTT
SCHEMBL23753336 0.90 ALDH1A1 (0.35) ALDH1A1HPGDSMN1; SMN2KDM4EHSD17B10
SCHEMBL31430673 0.90 ALDH1A1 (0.35) ALDH1A1HPGDSMN1; SMN2KDM4EHSD17B10
SCHEMBL31430767 0.89 RXRA (0.39) ALDH1A1MAPTNPSR1HTTHPGD
SCHEMBL23753322 0.89 RXRA (0.39) ALDH1A1MAPTNPSR1HTTHPGD
SCHEMBL23753323 0.88 SMN1; SMN2 (0.33) ALDH1A1HPGDSMN1; SMN2KDM4EHSD17B10
SCHEMBL31430743 0.88 SMN1; SMN2 (0.33) ALDH1A1HPGDSMN1; SMN2KDM4EHSD17B10
SCHEMBL23753390 0.88 ALDH1A1 (0.35) ALDH1A1MAPTNPSR1GAAHTT
SCHEMBL31430700 0.88 ALDH1A1 (0.35) ALDH1A1MAPTNPSR1GAAHTT
SCHEMBL23753328 0.87 ALDH1A1 (0.35) ALDH1A1HPGDSMN1; SMN2KDM4EHSD17B10

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-12253526-B2 Fluorescent dye and use thereof EISAI R&D MANAGEMENT CO., LTD. (JP) 2025-03-18 — — US disclosed
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