SCHEMBL31638853

SCHEMBL31638853

COC(=O)c1c(F)cc(Br)c2cnn(COCC[Si](C)(C)C)c12

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ DGAT1 O75907 3/20 0.36
▸ F2RL1 P55085 1/20 0.34
▸ NPC1 O15118 2/20 0.33
▸ NPSR1 Q6W5P4 2/20 0.33
▸ LMNA P02545 2/20 0.33
▸ S1PR4 O95977 1/20 0.33
▸ ALDH1A1 P00352 1/20 0.33
▸ MAPT P10636 1/20 0.33
▸ HPGD P15428 1/20 0.33
▸ XBP1 P17861 1/20 0.33
▸ S1PR1 P21453 1/20 0.33
▸ HTT P42858 1/20 0.33
▸ RAB9A P51151 1/20 0.33
▸ PKM P14618 1/20 0.32
▸ KLKB1 P03952 2/20 0.32
▸ TSHR P16473 2/20 0.31
▸ HSD17B10 Q99714 2/20 0.31
▸ KDM4E B2RXH2 1/20 0.31
▸ MEN1 O00255 1/20 0.31
▸ GAA P10253 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
SCHEMBL31638969 0.81 DGAT1 (0.36) DGAT1F2RL1
SCHEMBL31211006 0.80 KMT2A (0.38) DGAT1F2RL1NPC1NPSR1MAPT
SCHEMBL29593705 0.79 DGAT1 (0.39) DGAT1F2RL1
SCHEMBL22864153 0.79 DGAT1 (0.39) DGAT1F2RL1
SCHEMBL31639090 0.78 DGAT1 (0.36) DGAT1F2RL1
SCHEMBL23827125 0.78 GAA (0.36) DGAT1NPC1NPSR1MAPTTSHR
SCHEMBL31336366 0.78 GAA (0.36) DGAT1NPC1NPSR1MAPTTSHR
SCHEMBL27186102 0.77 TSHR (0.34) DGAT1NPC1NPSR1LMNAALDH1A1
SCHEMBL15509075 0.75 KMT2A (0.40) DGAT1F2RL1NPC1NPSR1LMNA
SCHEMBL1957623 0.74 F2RL1 (0.39) DGAT1F2RL1NPC1KLKB1

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-2025137329-A1 CERTAIN CHEMICAL ENTITIES, COMPOSITIONS, AND METHODS NEUPHARMA, INC (US) 2025-06-26 — — WO disclosed
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