SCHEMBL29198750

SCHEMBL29198750

CCO[Si](CCCOc1ncccn1)(OCC)OCC

nearest known ligand 0.38

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ NPC1 O15118 3/20 0.33
▸ RAB9A P51151 3/20 0.33
▸ SMN1; SMN2 Q16637 3/20 0.33
▸ HSD17B10 Q99714 2/20 0.33
▸ MAPT P10636 2/20 0.33
▸ MAPK1 P28482 2/20 0.33
▸ ALDH1A1 P00352 1/20 0.33
▸ ALOX15 P16050 1/20 0.33
▸ TSHR P16473 1/20 0.33
▸ MEN1 O00255 1/20 0.31
▸ KMT2A Q03164 1/20 0.31
▸ CYP1A2 P05177 1/20 0.31
▸ CYP2D6 P10635 1/20 0.31
▸ CYP19A1 P11511 1/20 0.31
▸ CYP2C9 P11712 1/20 0.31
▸ CYP2C19 P33261 1/20 0.31
▸ HPGD P15428 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
SCHEMBL25638950 0.77 L3MBTL1 (0.49) RAB9ASMN1; SMN2HSD17B10MAPTMAPK1
SCHEMBL2579282 0.76 KCNA3 (0.54) SMN1; SMN2ALDH1A1
SCHEMBL4268840 0.74 CYP2D6 (0.48) NPC1RAB9ASMN1; SMN2MAPTMAPK1
SCHEMBL30537732 0.74 MAPK1 (0.48) HSD17B10MAPTMAPK1ALDH1A1ALOX15
SCHEMBL15369243 0.73 MAPT (0.36) MAPTMAPK1
SCHEMBL4541652 0.73 LTA4H (0.44) MAPK1TSHRCYP1A2CYP2D6CYP19A1
SCHEMBL3503366 0.72 TSHR (0.33) MAPTTSHRMEN1KMT2A
SCHEMBL4280446 0.72 NPC1 (0.46) NPC1RAB9ASMN1; SMN2HSD17B10MAPT
SCHEMBL15736789 0.72 — —
SCHEMBL22634303 0.72 ELOVL1 (0.33) —

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117599620-A Composite silicon film for separating organic mixed solvent and preparation method and application thereof 常州大学 2024-02-27 — — CN claimed
CN-117599620-A Composite silicon film for separating organic mixed solvent and preparation method and application thereof 常州大学 2024-02-27 — — CN disclosed
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