SCHEMBL7301613

SCHEMBL7301613

O=C(O)C1CCN(C(=O)c2cccs2)CC1

nearest known ligand 0.74

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 5/20 0.74
▸ PABPC1 P11940 2/20 0.69
▸ EIF4H Q15056 2/20 0.69
▸ GAA P10253 2/20 0.66
▸ SMN1; SMN2 Q16637 3/20 0.62
▸ MAPT P10636 2/20 0.62
▸ NPC1 O15118 1/20 0.62
▸ RAB9A P51151 1/20 0.62
▸ ABL1 P00519 1/20 0.61
▸ RIN1 Q13671 1/20 0.61
▸ TDP1 Q9NUW8 1/20 0.61
▸ KDM4E B2RXH2 1/20 0.60
▸ THRB P10828 1/20 0.60
▸ L3MBTL1 Q9Y468 1/20 0.60
▸ HSD17B10 Q99714 1/20 0.57
▸ POLB P06746 1/20 0.57
▸ APOBEC3A P31941 1/20 0.56
▸ APOBEC3G Q9HC16 1/20 0.56
▸ HTT P42858 1/20 0.56
▸ CYP2D6 P10635 1/20 0.56

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
SCHEMBL6690761 0.91 ALDH1A1 (0.67) ALDH1A1PABPC1EIF4HGAASMN1; SMN2
SCHEMBL3455961 0.85 ALDH1A1 (1.00) ALDH1A1PABPC1EIF4HGAASMN1; SMN2
SCHEMBL9001940 0.84 GAA (0.70) ALDH1A1PABPC1EIF4HGAASMN1; SMN2
SCHEMBL11293119 0.83 GAA (0.85) ALDH1A1GAASMN1; SMN2MAPTHSD17B10
SCHEMBL357539 0.83 GAA (0.68) ALDH1A1PABPC1EIF4HGAASMN1; SMN2
SCHEMBL31668470 0.83 GAA (0.68) ALDH1A1PABPC1EIF4HGAASMN1; SMN2
SCHEMBL15070498 0.83 GAA (0.68) ALDH1A1PABPC1EIF4HGAASMN1; SMN2
SCHEMBL7233472 0.82 RAB9A (0.64) ALDH1A1PABPC1EIF4HGAASMN1; SMN2
SCHEMBL15498626 0.82 ALDH1A1 (0.65) ALDH1A1PABPC1EIF4HGAASMN1; SMN2
SCHEMBL27303865 0.82 MAPT (0.84) ALDH1A1PABPC1EIF4HGAASMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4008716-A1 NOVEL INHIBITORS OF INSULIN-LIKE GROWTH FACTOR 2 MRNA BINDING PROTEINS Martin-Luther-Universität Halle-Wittenberg (DE) 2022-06-08 — — EP disclosed
EP-4008717-A2 NOVEL INHIBITORS OF INSULIN-LIKE GROWTH FACTOR 2 MRNA BINDING PROTEINS Martin-Luther-Universität Halle-Wittenberg (DE) 2022-06-08 — — EP disclosed
EP-4008716-A1 NOVEL INHIBITORS OF INSULIN-LIKE GROWTH FACTOR 2 MRNA BINDING PROTEINS Martin-Luther-Universität Halle-Wittenberg (DE) 2022-06-08 — — EP disclosed
EP-4008717-A2 NOVEL INHIBITORS OF INSULIN-LIKE GROWTH FACTOR 2 MRNA BINDING PROTEINS Martin-Luther-Universität Halle-Wittenberg (DE) 2022-06-08 — — EP disclosed
EP-0520336-A2 Aldehyde derivatives and their use as calpain inhibitors FUJIREBIO Inc. (JP) 1992-12-30 — — EP disclosed
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