SCHEMBL31398241

SCHEMBL31398241

O[C@@H](CN(Cc1ccccc1)Cc1ccccc1)c1ccc(OCc2ccccc2)c(OCc2ccccc2)c1

nearest known ligand 0.49

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 4/20 0.45
▸ MEN1 O00255 3/20 0.45
▸ BCHE P06276 1/20 0.41
▸ POLB P06746 3/20 0.40
▸ C5AR1 P21730 1/20 0.40
▸ UBE2N P61088 1/20 0.40
▸ SLC2A1 P11166 1/20 0.40
▸ L3MBTL1 Q9Y468 1/20 0.39
▸ F2 P00734 1/20 0.39
▸ F10 P00742 1/20 0.39
▸ PRSS1 P07477 1/20 0.39
▸ PRSS2 P07478 1/20 0.39
▸ F7 P08709 1/20 0.39
▸ F3 P13726 1/20 0.39
▸ PRSS3 P35030 1/20 0.39
▸ GAA P10253 1/20 0.39
▸ PRMT5 O14744 1/20 0.39
▸ WDR77 Q9BQA1 1/20 0.39

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
SCHEMBL10463996 0.85 MEN1 (0.43) KMT2AMEN1BCHEPOLBL3MBTL1
SCHEMBL3978402 0.84 ADRA1D (0.45) KMT2AMEN1POLBL3MBTL1
SCHEMBL21462783 0.83 MEN1 (0.47) KMT2AMEN1POLBF2F10
SCHEMBL21462785 0.83 MEN1 (0.47) KMT2AMEN1POLBF2F10
SCHEMBL3978396 0.82 ADRB2 (0.43) KMT2AMEN1L3MBTL1PRMT5WDR77
SCHEMBL7293528 0.82 BCHE (0.51) KMT2AMEN1BCHE
SCHEMBL7086395 0.81 KMT2A (0.38) KMT2AMEN1
SCHEMBL11670452 0.81 MEN1 (0.39) KMT2AMEN1BCHEPOLBPRMT5
SCHEMBL6074837 0.81 ADRB3 (0.50) —
SCHEMBL10477685 0.81 BCHE (0.49) KMT2AMEN1BCHEPOLBL3MBTL1

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-2025040359-A1 METHOD FOR THE SYNTHESIS OF (1R)-2-(DIBENZYLAMINO)-1-(3,4-DIBENZYLOXYPHENYL)ETHANOL, NOVEL INTERMEDIATES OF SAID METHOD AND USE OF THE PRODUCT IN THE SYNTHESIS OF NORADRENALINE MOEHS IBERICA, S.L. (ES) 2025-02-27 — — WO disclosed
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