SCHEMBL31580150

SCHEMBL31580150

CN(C)c1ccc2c(c1)[Si](C)(C)c1cc(N(C)C)ccc1C21OC(=O)c2ccc(C(=O)O)cc21

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ HPGD P15428 3/20 0.45
▸ ALDH1A1 P00352 2/20 0.45
▸ TDP1 Q9NUW8 2/20 0.45
▸ CYP3A4 P08684 1/20 0.45
▸ HIF1A Q16665 1/20 0.45
▸ HSD17B10 Q99714 1/20 0.45
▸ GAA P10253 1/20 0.41
▸ PKM P14618 1/20 0.41
▸ MEN1 O00255 5/20 0.40
▸ KMT2A Q03164 5/20 0.40
▸ MAPT P10636 3/20 0.35
▸ LMNA P02545 2/20 0.35
▸ HTT P42858 2/20 0.35
▸ USP2 O75604 1/20 0.35
▸ FTO Q9C0B1 4/20 0.34
▸ POLB P06746 2/20 0.34
▸ ALOX12 P18054 1/20 0.34
▸ NPSR1 Q6W5P4 1/20 0.34
▸ GPR55 Q9Y2T6 1/20 0.34
▸ CYP2C19 P33261 1/20 0.34

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
SCHEMBL24621995 0.89 ALDH1A1 (0.44) HPGDALDH1A1TDP1CYP3A4HIF1A
SCHEMBL23753349 0.87 ALDH1A1 (0.42) HPGDALDH1A1TDP1CYP3A4HIF1A
SCHEMBL31430664 0.87 ALDH1A1 (0.42) HPGDALDH1A1TDP1CYP3A4HIF1A
SCHEMBL31430683 0.86 HPGD (0.41) HPGDALDH1A1TDP1CYP3A4HIF1A
SCHEMBL23753327 0.86 HPGD (0.41) HPGDALDH1A1TDP1CYP3A4HIF1A
SCHEMBL31580086 0.85 HPGD (0.48) HPGDALDH1A1TDP1CYP3A4HIF1A
SCHEMBL16745253 0.85 HPGD (0.48) HPGDALDH1A1TDP1CYP3A4HIF1A
SCHEMBL29395325 0.82 HPGD (0.51) HPGDALDH1A1TDP1CYP3A4HIF1A
SCHEMBL16865784 0.82 TDP1 (0.56) HPGDALDH1A1TDP1CYP3A4HIF1A
SCHEMBL30335042 0.82 TDP1 (0.56) HPGDALDH1A1TDP1CYP3A4HIF1A

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-2025104141-A1 NOVEL REVERSIBLE FLUORESCENT PROBES FOR CB2 F. HOFFMANN-LA ROCHE AG (CH) 2025-05-22 — — WO disclosed
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