SCHEMBL14769839

SCHEMBL14769839

CCCCN1/C(=C/c2c(O)c(=O)c2=O)C(C)(C)c2ccccc21

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 9/20 0.47
KMT2A Q03164 8/20 0.47
MEN1 O00255 7/20 0.47
MAPT P10636 7/20 0.47
SMN1; SMN2 Q16637 6/20 0.47
HTT P42858 5/20 0.47
GPR55 Q9Y2T6 3/20 0.47
GLA P06280 1/20 0.47
KDM4E B2RXH2 6/20 0.43
MAPK1 P28482 3/20 0.43
L3MBTL1 Q9Y468 2/20 0.43
NPSR1 Q6W5P4 1/20 0.43
GAA P10253 2/20 0.41
TDP1 Q9NUW8 2/20 0.41
HPGD P15428 1/20 0.41
ALOX12 P18054 1/20 0.41
TP53 P04637 1/20 0.41
CYP1A2 P05177 1/20 0.40
CYP2D6 P10635 1/20 0.40
RAB9A P51151 1/20 0.39

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
SCHEMBL12156977 0.95 ALDH1A1 (0.43) ALDH1A1KMT2AMEN1MAPTSMN1; SMN2
SCHEMBL21314809 0.95 ALDH1A1 (0.43) ALDH1A1KMT2AMEN1MAPTSMN1; SMN2
SCHEMBL21314807 0.95 ALDH1A1 (0.43) ALDH1A1KMT2AMEN1MAPTSMN1; SMN2
SCHEMBL12156970 0.94 MAPT (0.47) ALDH1A1KMT2AMEN1MAPTSMN1; SMN2
SCHEMBL15947424 0.93 MAPT (0.47) ALDH1A1KMT2AMEN1MAPTSMN1; SMN2
SCHEMBL14769832 0.88 MAPT (0.48) ALDH1A1KMT2AMEN1MAPTSMN1; SMN2
SCHEMBL16319609 0.88 MAPT (0.48) ALDH1A1KMT2AMEN1MAPTSMN1; SMN2
SCHEMBL13103145 0.87 KMT2A (0.38) ALDH1A1KMT2AMEN1MAPTSMN1; SMN2
SCHEMBL16328777 0.86 KMT2A (0.43) ALDH1A1KMT2AMEN1MAPTSMN1; SMN2
SCHEMBL13970823 0.86 KMT2A (0.53) ALDH1A1KMT2AMEN1MAPTSMN1; SMN2

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
US-20130061929-A1 PHOTOELECTRIC CONVERSION ELEMENT, METHOD FOR PRODUCING PHOTOELECTRIC CONVERSION ELEMENT, AND SOLAR CELL KONICA MINOLTA BUSINESS TECHNOLOGIES, INC. (JP) 2013-03-14 US disclosed