SCHEMBL13310201

SCHEMBL13310201

CC(C)(I)OC(=O)NCc1ccccc1N

nearest known ligand 0.47

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
HPGD P15428 6/20 0.47
ALDH1A1 P00352 5/20 0.47
KDM4E B2RXH2 3/20 0.47
RCE1 Q9Y256 1/20 0.47
KCNA5 P22460 2/20 0.46
HDAC1 Q13547 1/20 0.42
HDAC10 Q969S8 1/20 0.40
HDAC6 Q9UBN7 1/20 0.40
KDM4A O75164 1/20 0.39
CYP3A4 P08684 2/20 0.39
CYP2D6 P10635 1/20 0.39
FDPS P14324 1/20 0.39
CYP2C19 P33261 1/20 0.39
RIPK1 Q13546 2/20 0.38
KMT2A Q03164 1/20 0.37
PRP4K Q13523 1/20 0.37
DYRK1A Q13627 1/20 0.37
DYRK1B Q9Y463 1/20 0.37

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
SCHEMBL2061998 0.88 KCNA5 (0.54) HPGDALDH1A1KDM4ERCE1KCNA5
SCHEMBL8568942 0.81 HPGD (0.57) HPGDALDH1A1KDM4ERCE1KCNA5
SCHEMBL27482218 0.81 KCNA5 (0.48) HPGDALDH1A1KDM4ERCE1KCNA5
SCHEMBL19318518 0.76 HPGD (0.53) HPGDALDH1A1KDM4ERCE1HDAC1
SCHEMBL8018113 0.76 KCNA5 (0.56) KCNA5HDAC1HDAC10HDAC6KDM4A
SCHEMBL30159605 0.76 KCNA5 (0.56) KCNA5HDAC1HDAC10HDAC6KDM4A
SCHEMBL6676878 0.75 KCNA5 (0.46) HPGDALDH1A1KDM4ERCE1KCNA5
SCHEMBL27273924 0.75 NQO2 (0.46) HPGDALDH1A1KDM4ERCE1KCNA5
SCHEMBL10416108 0.74 HPGD (0.57) HPGDALDH1A1KDM4ERCE1HDAC1
SCHEMBL28584573 0.73 ALDH1A1 (0.47) HPGDALDH1A1KDM4ERCE1KCNA5

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
EP-2202231-A1 2,3-DIHYDROIMINOISOINDOLE DERIVATIVE Eisai R&D Management Co., Ltd. (JP) 2010-06-30 EP disclosed