SCHEMBL28617147

SCHEMBL28617147

CCn1c(=O)cc(C2CCN(C(=O)O)CC2)c2cc(C(=O)N(C)c3ccccc3)ccc21

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 5/20 0.45
ALDH1A1 P00352 7/20 0.41
TSHR P16473 3/20 0.41
HPGD P15428 3/20 0.41
L3MBTL1 Q9Y468 2/20 0.40
POLB P06746 1/20 0.40
BRD4 O60885 1/20 0.39
MEN1 O00255 1/20 0.38
KMT2A Q03164 1/20 0.38
HSD17B10 Q99714 3/20 0.38
SMN1; SMN2 Q16637 3/20 0.38
NPSR1 Q6W5P4 1/20 0.38
REV1 Q9UBZ9 1/20 0.37
USP2 O75604 1/20 0.37
UBE2N P61088 1/20 0.37
HTT P42858 3/20 0.37
MAPT P10636 2/20 0.37
LMNA P02545 1/20 0.37
KDM1A O60341 1/20 0.36
MAOA P21397 1/20 0.36

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
SCHEMBL20183528 0.93 KDM4E (0.48) KDM4EALDH1A1TSHRL3MBTL1POLB
SCHEMBL21458748 0.93 BRD4 (0.40) KDM4EALDH1A1TSHRHPGDBRD4
SCHEMBL20183682 0.91 KDM4E (0.46) KDM4EALDH1A1TSHRHPGDL3MBTL1
SCHEMBL20183878 0.91 KDM4E (0.46) KDM4EALDH1A1TSHRHPGDL3MBTL1
SCHEMBL20183621 0.90 KDM4E (0.46) KDM4EALDH1A1TSHRHPGDL3MBTL1
SCHEMBL20183623 0.89 KDM4E (0.45) KDM4EALDH1A1L3MBTL1POLBBRD4
SCHEMBL20183627 0.89 CNR2 (0.44) KDM4EBRD4MEN1KMT2AHSD17B10
SCHEMBL20183785 0.88 KDM4E (0.43) KDM4EALDH1A1L3MBTL1POLBBRD4
SCHEMBL20183700 0.88 MEN1 (0.42) KDM4EALDH1A1TSHRHPGDBRD4
SCHEMBL20183811 0.87 ALDH1A1 (0.42) KDM4EALDH1A1TSHRHPGDBRD4

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-108137505-B Nitrogen-containing heterocyclic compound 富士胶片株式会社 2021-07-06 CN disclosed