SCHEMBL28266239

SCHEMBL28266239

COC(=O)c1ccc(Nc2ccc(C(C)C)cc2)cc1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CDC25A P30304 1/20 0.54
CDC25B P30305 1/20 0.54
MEN1 O00255 6/20 0.51
KMT2A Q03164 6/20 0.51
HPGD P15428 3/20 0.51
KDM4E B2RXH2 2/20 0.51
RXFP1 Q9HBX9 1/20 0.51
RAB9A P51151 4/20 0.51
MAPT P10636 4/20 0.51
NPC1 O15118 2/20 0.51
CA1 P00915 2/20 0.50
CA2 P00918 2/20 0.50
SMN1; SMN2 Q16637 1/20 0.50
TDP1 Q9NUW8 1/20 0.50
CA12 O43570 1/20 0.50
CA7 P43166 1/20 0.50
CA9 Q16790 1/20 0.50
CA14 Q9ULX7 1/20 0.50
ALDH1A1 P00352 2/20 0.49
L3MBTL1 Q9Y468 2/20 0.49

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
SCHEMBL84424 0.91 CA1 (0.59) MEN1KMT2AKDM4ERAB9AMAPT
SCHEMBL1505883 0.87 MEN1 (0.64) MEN1KMT2AHPGDKDM4ERXFP1
SCHEMBL2627834 0.85 CA1 (0.56) KDM4ERAB9AMAPTNPC1CA1
SCHEMBL4609954 0.85 RAB9A (0.67) MEN1KMT2AHPGDKDM4ERAB9A
SCHEMBL4609178 0.85 RAB9A (0.67) MEN1KMT2AHPGDKDM4ERAB9A
SCHEMBL182001 0.82 PTGS2 (0.55) MEN1KMT2AKDM4ERAB9AMAPT
SCHEMBL21165786 0.82 CA1 (0.58) MEN1KMT2AHPGDKDM4ERAB9A
SCHEMBL28266243 0.81 DHODH (0.58) CDC25ACDC25BMEN1KMT2AHPGD
SCHEMBL1845601 0.81 CA1 (0.71) MEN1KMT2AHPGDKDM4ERAB9A
SCHEMBL181924 0.80 ALDH1A1 (0.49) MEN1KMT2AHPGDKDM4ERAB9A

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-109206360-A Carbazole amide derivatives or its salt and its preparation method and application 复旦大学 2019-01-15 CN disclosed