SCHEMBL28022639

SCHEMBL28022639

C=C(O)C(=O)Oc1c(C)ccc(C(=O)c2ccccc2)c1NC

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ELANE P08246 4/20 0.40
MAPT P10636 5/20 0.38
MAPK1 P28482 3/20 0.38
NPSR1 Q6W5P4 1/20 0.38
TSHR P16473 1/20 0.38
MEN1 O00255 2/20 0.37
KMT2A Q03164 2/20 0.37
USP2 O75604 1/20 0.37
GAA P10253 1/20 0.37
KEAP1 Q14145 1/20 0.37
NFE2L2 Q16236 1/20 0.37
KDM4E B2RXH2 2/20 0.37
HSD17B10 Q99714 2/20 0.37
ALOX15 P16050 1/20 0.37
ALDH1A1 P00352 2/20 0.36
HPGD P15428 2/20 0.36
LMNA P02545 1/20 0.36
CYP1A2 P05177 1/20 0.36
PGR P06401 1/20 0.36
CYP2D6 P10635 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
SCHEMBL27590753 0.81 ALDH1A1 (0.40) ELANEMAPTMAPK1NPSR1KDM4E
SCHEMBL27519700 0.75 GAA (0.46) MAPTMAPK1NPSR1TSHRMEN1
SCHEMBL28048336 0.75 CCNB2 (0.46) MAPTTSHRMEN1KMT2AALDH1A1
SCHEMBL27459292 0.72 MAPT (0.55) ELANEMAPTMAPK1NPSR1KMT2A
SCHEMBL27874052 0.72 THRB (0.36) ELANEMAPTMAPK1NPSR1MEN1
SCHEMBL27486704 0.71 KDM4E (0.42) MAPTMAPK1TSHRMEN1KMT2A
SCHEMBL31315830 0.70 ELANE (0.61) ELANEMAPTMAPK1TSHRGAA
SCHEMBL27618014 0.70 HSD17B10 (0.43) ELANEMAPTMAPK1NPSR1TSHR
SCHEMBL25306544 0.70 MAPT (0.43) ELANEMAPTMAPK1NPSR1TSHR
SCHEMBL28854113 0.69 MAPT (0.53) MAPTMAPK1NPSR1MEN1KMT2A

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-104755556-A Organic solvent dispersoid for conductive polymer/polyanion complex, conductive composition containing said dispersoid, and conductive film obtained from said composition ARAKAWA CHEM IND 2015-07-01 CN disclosed