SCHEMBL822603

SCHEMBL822603

CNC(=O)c1cc(C(C)(c2ccc(C(=O)O)c(C(=O)Nc3cc(C(C)(c4ccc(O)c(C)c4)C(F)(F)F)ccc3O)c2)C(F)(F)F)ccc1C(=O)O

nearest known ligand 0.42

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
SORT1 Q99523 10/20 0.42
AKT1 P31749 1/20 0.42
GAA P10253 1/20 0.41
MEN1 O00255 1/20 0.40
KMT2A Q03164 1/20 0.40
TMPRSS4 Q9NRS4 2/20 0.38
KCNMA1 Q12791 3/20 0.38
NR1H4 Q96RI1 2/20 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
SCHEMBL12917926 0.95 AKT1 (0.43) SORT1AKT1GAAMEN1KMT2A
SCHEMBL2622756 0.90 SORT1 (0.43) SORT1AKT1GAAMEN1KMT2A
SCHEMBL10007441 0.80 AKT1 (0.36) SORT1AKT1GAAMEN1KMT2A
SCHEMBL13292496 0.79 TDP1 (0.39) SORT1AKT1GAATMPRSS4NR1H4
SCHEMBL15695614 0.75 SORT1 (0.44) SORT1GAANR1H4
SCHEMBL12789487 0.75 MAPK1 (0.49) SORT1GAAMEN1KMT2ANR1H4
SCHEMBL19846834 0.74 KCNMA1 (0.60) AKT1GAAMEN1KMT2AKCNMA1
SCHEMBL18968832 0.74 SORT1 (0.40) SORT1MEN1KMT2ANR1H4
SCHEMBL9610063 0.74 SORT1 (0.48) SORT1NR1H4
SCHEMBL21360957 0.73 AKT1 (0.39) AKT1MEN1KMT2ATMPRSS4KCNMA1

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20160111698-A1 SEPARATOR FOR LITHIUM SECONDARY BATTERY AND METHOD FOR MANUFACTURING SAME IUCF HYU (KR) 2016-04-21 US disclosed
US-20130115519-A1 SEPARATOR FOR LITHIUM SECONDARY BATTERY AND METHOD FOR MANUFACTURING SAME ICUF-HYU (Industry-University Cooperation Foundati Hanyang Unversity (KR) 2013-05-09 US disclosed
US-20110269857-A1 POLYMER AND METHOD OF PREPARING THE SAME INDUSTRY-UNIVERSITY COOPERATION FOUNDATION, HANYANG UNIVERSITY (KR) 2011-11-03 US disclosed