SCHEMBL29104598

SCHEMBL29104598

O=C(NCCc1ccc(CCNC(=O)N2CC2)cc1)N1CC1

nearest known ligand 0.67

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 3/20 0.67
▸ MEN1 O00255 2/20 0.67
▸ SMN1; SMN2 Q16637 1/20 0.67
▸ TPSAB1 Q15661 5/20 0.58
▸ TPSD1 Q9BZJ3 2/20 0.58
▸ TPSG1 Q9NRR2 2/20 0.58
▸ F2 P00734 1/20 0.53
▸ PLG P00747 1/20 0.53
▸ PRSS1 P07477 1/20 0.53
▸ EPHX1 P07099 1/20 0.49
▸ EPHX2 P34913 1/20 0.49
▸ ALDH1A1 P00352 2/20 0.49
▸ MAPK1 P28482 1/20 0.49
▸ NAMPT P43490 2/20 0.49
▸ TAAR1 Q96RJ0 1/20 0.48
▸ KDM4E B2RXH2 2/20 0.48
▸ F13A1 P00488 1/20 0.47

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
SCHEMBL311932 0.84 GAA (0.67) KMT2AMEN1SMN1; SMN2TPSAB1EPHX1
SCHEMBL5476364 0.84 KDM4E (0.71) KMT2AMEN1SMN1; SMN2TPSAB1ALDH1A1
SCHEMBL5210565 0.83 GAA (0.69) KMT2AMEN1SMN1; SMN2TPSAB1EPHX1
SCHEMBL17117320 0.82 DRD2 (0.65) KMT2AMEN1SMN1; SMN2TPSAB1ALDH1A1
SCHEMBL7494819 0.82 SMN1; SMN2 (0.50) KMT2AMEN1SMN1; SMN2TPSAB1TPSD1
SCHEMBL14372213 0.82 CHRM5 (0.62) KMT2AMEN1SMN1; SMN2NAMPT
SCHEMBL8472774 0.81 EPHX1 (0.54) KMT2AMEN1SMN1; SMN2EPHX1EPHX2
SCHEMBL7078436 0.81 KMT2A (0.75) KMT2AMEN1SMN1; SMN2TPSAB1TPSD1
SCHEMBL4974210 0.80 TPSAB1 (0.55) KMT2AMEN1SMN1; SMN2TPSAB1ALDH1A1
SCHEMBL17117274 0.80 KMT2A (0.69) KMT2AMEN1SMN1; SMN2TPSAB1TPSD1

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-117015566-A Stabilizer composition, use of a stabilizer composition, method for stabilizing polycondensates against hydrolytic degradation, and hydrolytically stable compositions and mouldings or mouldings thereof 弗劳恩霍夫应用研究促进协会 2023-11-07 — — CN claimed
CN-117015566-A Stabilizer composition, use of a stabilizer composition, method for stabilizing polycondensates against hydrolytic degradation, and hydrolytically stable compositions and mouldings or mouldings thereof 弗劳恩霍夫应用研究促进协会 2023-11-07 — — CN disclosed
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