SCHEMBL28936560

SCHEMBL28936560

CCC(=O)NCCC(C(=O)O)C(C)C

nearest known ligand 0.48

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 2/20 0.48
▸ KMT2A Q03164 2/20 0.48
▸ MTNR1A P48039 2/20 0.38
▸ MTNR1B P49286 2/20 0.38
▸ ALDH1A1 P00352 2/20 0.38
▸ SLC1A3 P43003 1/20 0.38
▸ SLC1A2 P43004 1/20 0.38
▸ SLC1A1 P43005 1/20 0.38
▸ ECE1 P42892 2/20 0.37
▸ RECQL P46063 1/20 0.37
▸ POLB P06746 1/20 0.36
▸ HPGD P15428 1/20 0.36
▸ SMN1; SMN2 Q16637 1/20 0.34
▸ LMNA P02545 1/20 0.34
▸ PKM P14618 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
SCHEMBL23220238 0.87 KMT2A (0.59) MEN1KMT2AALDH1A1SLC1A3SLC1A2
SCHEMBL1285155 0.77 MEN1 (0.58) MEN1KMT2AALDH1A1POLBHPGD
SCHEMBL12650483 0.76 MEN1 (0.52) MEN1KMT2AMTNR1AMTNR1BALDH1A1
SCHEMBL21227418 0.75 ALDH1A1 (0.59) MEN1KMT2AMTNR1AMTNR1BALDH1A1
SCHEMBL23018947 0.75 SLC1A3 (0.43) SLC1A3SLC1A2SLC1A1ECE1
Ethane SCHEMBL29184108 0.74 CHRM1 (0.50) SLC1A3SLC1A2SLC1A1
SCHEMBL1768830 0.74 KMT2A (0.50) MEN1KMT2ASLC1A3SLC1A2SLC1A1
SCHEMBL1768826 0.74 KMT2A (0.50) MEN1KMT2ASLC1A3SLC1A2SLC1A1
SCHEMBL8851229 0.74 MEN1 (0.54) MEN1KMT2AMTNR1AMTNR1BALDH1A1
SCHEMBL25853656 0.74 MEN1 (0.54) MEN1KMT2AMTNR1AMTNR1BALDH1A1

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-115466189-B Purification method of amino acid and derivative thereof 安徽普利药业有限公司 2024-08-30 — — CN disclosed
CN-115466189-A Preparation and purification method of amino acid and derivatives thereof 安徽普利药业有限公司 2022-12-13 — — CN disclosed
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