SCHEMBL28998610

SCHEMBL28998610

Cc1cn(-c2ccc(C(=O)O)cc2)nc(C(=O)O)c1=O

nearest known ligand 0.44

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 6/20 0.44
MEN1 O00255 4/20 0.44
POLB P06746 3/20 0.44
TDP1 Q9NUW8 3/20 0.44
ALDH1A1 P00352 3/20 0.44
KDM4E B2RXH2 2/20 0.44
MAPT P10636 2/20 0.44
HPGD P15428 1/20 0.44
APEX1 P27695 1/20 0.44
HTT P42858 1/20 0.43
CYP2C9 P11712 1/20 0.42
MAOA P21397 1/20 0.41
MAOB P27338 1/20 0.41
USP2 O75604 1/20 0.41
PTGS2 P35354 1/20 0.41
DGAT1 O75907 1/20 0.40
SMN1; SMN2 Q16637 2/20 0.40
DDAH1 O94760 1/20 0.40
RAB9A P51151 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
SCHEMBL28351546 0.88 CYP2C9 (0.55) KMT2AMEN1POLBTDP1ALDH1A1
SCHEMBL10266978 0.85 ALDH1A1 (0.43) KMT2AMEN1POLBALDH1A1KDM4E
SCHEMBL31244457 0.85 CYP1A2 (0.44) KMT2AMEN1POLBTDP1ALDH1A1
SCHEMBL31244458 0.85 CYP1A2 (0.44) KMT2AMEN1POLBTDP1ALDH1A1
SCHEMBL31665904 0.78 KMT2A (0.50) KMT2AMEN1POLBALDH1A1KDM4E
SCHEMBL10267021 0.77 NPC1 (0.42) KMT2AMEN1ALDH1A1KDM4EHPGD
Trolamine SCHEMBL11120805 0.77 KDM4E (0.46) KMT2AALDH1A1KDM4EMAPTCYP2C9
SCHEMBL29046990 0.76 NPC1 (0.59) POLBTDP1ALDH1A1KDM4EMAPT
SCHEMBL4302959 0.76 CYP2C9 (0.56) KMT2AMEN1POLBTDP1ALDH1A1
SCHEMBL2220566 0.75 NPC1 (0.34) KMT2AMEN1ALDH1A1KDM4EMAPT

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
CN-114920942-B Cadmium (II) ion coordination polymer and preparation method and application thereof 陕西理工大学 2023-07-28 CN claimed
CN-114920942-A Cadmium (II) ion coordination polymer and preparation method and application thereof 陕西理工大学 2022-08-19 CN claimed
CN-118374007-A Divalent manganese ion coordination polymer and preparation method and application thereof 陕西理工大学 2024-07-23 CN disclosed
CN-114920942-B Cadmium (II) ion coordination polymer and preparation method and application thereof 陕西理工大学 2023-07-28 CN disclosed
CN-114920942-A Cadmium (II) ion coordination polymer and preparation method and application thereof 陕西理工大学 2022-08-19 CN disclosed