SCHEMBL28923751

SCHEMBL28923751

CC1N(CC(=O)O)c2ccccc2N1CC(=O)O

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BRD4 O60885 1/20 0.43
KDM4E B2RXH2 2/20 0.41
APEX1 P27695 1/20 0.41
CA12 O43570 1/20 0.41
CA9 Q16790 1/20 0.41
AKR1B1 P15121 1/20 0.41
SLC6A9 P48067 2/20 0.40
CHRM2 P08172 3/20 0.40
CHRM4 P08173 3/20 0.40
CHRM1 P11229 3/20 0.40
NPSR1 Q6W5P4 1/20 0.40
KMT2A Q03164 3/20 0.40
MEN1 O00255 2/20 0.40
ALDH1A1 P00352 2/20 0.40
LMNA P02545 1/20 0.40
MAPT P10636 1/20 0.40
ALOX12 P18054 1/20 0.40
RECQL P46063 1/20 0.40
CHRM3 P20309 2/20 0.39
GAA P10253 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
SCHEMBL22431489 0.79 L3MBTL1 (0.43) BRD4CHRM2CHRM4CHRM1NPSR1
SCHEMBL22781187 0.79 KDM4E (0.49) KDM4EKMT2AMEN1LMNAGAA
SCHEMBL29981821 0.75 EGFR (0.38) BRD4KDM4EAPEX1CA12CA9
SCHEMBL9618341 0.72 CA12 (0.65) KDM4EAPEX1CA12CA9AKR1B1
SCHEMBL16525690 0.72 GRIA1 (0.38) BRD4KDM4ECHRM2CHRM4CHRM1
SCHEMBL18844475 0.71 BRD4 (0.53) BRD4LMNAALOX12MAPK1
SCHEMBL27458289 0.68 KMT2A (0.41) KDM4EAPEX1CA12CA9AKR1B1
SCHEMBL25384733 0.68 GAA (0.39) KDM4EKMT2AMEN1ALDH1A1LMNA
SCHEMBL5279207 0.67 PTGDR2 (0.50) KDM4EAPEX1CA12CA9NPSR1
SCHEMBL5281625 0.67 PTGDR2 (0.50) KDM4EAPEX1CA12CA9NPSR1

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-115532235-A Lanthanum-based adsorbent and preparation method and application thereof 湖南大学 2022-12-30 CN claimed
CN-115532235-A Lanthanum-based adsorbent and preparation method and application thereof 湖南大学 2022-12-30 CN disclosed