SCHEMBL16693248

SCHEMBL16693248

C=C(C)C(=O)OCc1ccc(/N=N/c2cc(C(=O)c3ccccc3)c(O)cc2OCC)cc1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HPGD P15428 6/20 0.42
MAPT P10636 6/20 0.42
LMNA P02545 5/20 0.42
CYP3A4 P08684 2/20 0.42
KDM4E B2RXH2 2/20 0.42
RECQL P46063 2/20 0.42
HSD17B10 Q99714 2/20 0.42
ALDH1A1 P00352 7/20 0.36
KMT2A Q03164 3/20 0.36
HTT P42858 4/20 0.35
CYP2C19 P33261 3/20 0.35
CYP1A2 P05177 2/20 0.35
PGR P06401 1/20 0.35
CYP2D6 P10635 1/20 0.35
SLC6A2 P23975 1/20 0.35
PDE4A P27815 1/20 0.35
MAPK1 P28482 1/20 0.35
HRH1 P35367 1/20 0.35
SLC6A3 Q01959 1/20 0.35
PDE4D Q08499 1/20 0.35

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
SCHEMBL16693249 0.91 LMNA (0.38) HPGDMAPTLMNACYP3A4KDM4E
SCHEMBL16693303 0.91 LMNA (0.40) HPGDMAPTLMNACYP3A4KDM4E
SCHEMBL16693264 0.91 MAPT (0.51) HPGDMAPTLMNACYP3A4KDM4E
SCHEMBL373543 0.89 HPGD (0.41) HPGDMAPTLMNACYP3A4KDM4E
SCHEMBL7178326 0.89 HPGD (0.41) HPGDMAPTLMNACYP3A4KDM4E
SCHEMBL16693285 0.88 MAPT (0.38) HPGDMAPTLMNACYP3A4KDM4E
SCHEMBL15359142 0.85 LMNA (0.39) HPGDMAPTLMNACYP3A4KDM4E
SCHEMBL16693294 0.85 SIRT5 (0.37) HPGDMAPTLMNACYP3A4KDM4E
SCHEMBL16594950 0.84 SMN1; SMN2 (0.40) HPGDMAPTLMNACYP3A4KDM4E
SCHEMBL15359171 0.84 SMN1; SMN2 (0.40) HPGDMAPTLMNACYP3A4KDM4E

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
WO-2015064674-A1 METHOD FOR MANUFACTURING POLYMERIZABLE UV-ABSORBING DYE 興和株式会社 2015-05-07 WO disclosed