SCHEMBL31574397

SCHEMBL31574397

CN(C)CC(=O)Nc1cc(C(=O)O)cc(C(=O)O)c1

nearest known ligand 0.54

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 8/20 0.51
MEN1 O00255 7/20 0.51
GAA P10253 1/20 0.51
ALDH1A1 P00352 3/20 0.49
KDM4E B2RXH2 2/20 0.49
POLB P06746 2/20 0.48
MAPT P10636 1/20 0.47
L3MBTL1 Q9Y468 2/20 0.47
PKM P14618 1/20 0.47
USP2 O75604 1/20 0.43
TDP1 Q9NUW8 1/20 0.43

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
SCHEMBL1066727 0.82 MAPT (0.59) ALDH1A1MAPTL3MBTL1
SCHEMBL29141123 0.79 KMT2A (0.56) KMT2AMEN1GAAALDH1A1KDM4E
SCHEMBL5705415 0.78 GAA (0.54) KMT2AMEN1GAAALDH1A1KDM4E
SCHEMBL1821602 0.76 GAA (0.61) KMT2AMEN1GAAALDH1A1KDM4E
SCHEMBL782086 0.76 GAA (0.56) KMT2AMEN1GAAALDH1A1KDM4E
SCHEMBL1808155 0.76 GAA (0.56) KMT2AMEN1GAAKDM4EPOLB
SCHEMBL7049647 0.76 MAPT (0.60) GAAALDH1A1MAPTL3MBTL1
SCHEMBL31440566 0.75 MAPT (0.47) KMT2AALDH1A1POLBMAPTL3MBTL1
SCHEMBL3078787 0.75 PTPN1 (0.56) KMT2AMEN1GAAKDM4EPOLB
SCHEMBL10076299 0.75 MAPT (0.47) KMT2AMEN1ALDH1A1KDM4EPOLB

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-119980701-A Wear-resistant anti-pilling composite fabric and preparation method thereof 普宁市大西豪服装制造有限公司 2025-05-13 CN claimed
CN-119980701-A Wear-resistant anti-pilling composite fabric and preparation method thereof 普宁市大西豪服装制造有限公司 2025-05-13 CN disclosed