SCHEMBL13921990

SCHEMBL13921990

CCN(CC)C(=O)C1CCC(NC(=O)NC(=O)C(C)(C)CC)CC1

nearest known ligand 0.39

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
RECQL P46063 1/20 0.36
TSHR P16473 1/20 0.35
EPHX1 P07099 3/20 0.35
EPHX2 P34913 3/20 0.35
KMT2A Q03164 1/20 0.34
CCR2 P41597 1/20 0.34
ALDH1A1 P00352 2/20 0.33
KDM4E B2RXH2 1/20 0.33
PKM P14618 1/20 0.33
HPGD P15428 2/20 0.32
KDM5A P29375 1/20 0.32
NPSR1 Q6W5P4 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.32

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
SCHEMBL10110683 0.82 RECQL (0.39) RECQLEPHX1EPHX2CCR2ALDH1A1
SCHEMBL1104154 0.78 EPHX1 (0.37) RECQLEPHX1EPHX2CCR2ALDH1A1
SCHEMBL18909746 0.73 CCR2 (0.49) EPHX1CCR2ALDH1A1PKMKDM5A
SCHEMBL1289738 0.73 ALDH1A1 (0.47) KMT2AALDH1A1KDM4EPKMHPGD
SCHEMBL14114327 0.71 CCR2 (0.42) RECQLCCR2ALDH1A1PKMKDM5A
Hydrochloric Acid SCHEMBL1289689 0.71 ALDH1A1 (0.46) KMT2AALDH1A1KDM4EPKMHPGD
SCHEMBL13010038 0.69 EPHX1 (0.44) EPHX1EPHX2KMT2AALDH1A1KDM4E
SCHEMBL1104175 0.69 POLB (0.41) CCR2ALDH1A1PKMKDM5A
SCHEMBL14008106 0.67 CCR2 (0.41) EPHX1CCR2ALDH1A1PKMKDM5A
SCHEMBL1104177 0.67 HSD11B1 (0.44) TSHRKMT2ACCR2ALDH1A1KDM4E

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
US-7507525-B2 Polymerizable composition and lithographic printing plate precursor FUJIFILM CORPORATION (JP) 2009-03-24 US disclosed
US-7279539-B2 Alkali-soluble polymer and polymerizable composition thereof FUJIFILM CORPORATION (JP) 2007-10-09 US disclosed