SCHEMBL1708800

SCHEMBL1708800

Nc1cc(C(=O)O)c(N)cc1OC=O

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
IDO1 P14902 1/20 0.43
ALDH1A1 P00352 7/20 0.42
HPGD P15428 3/20 0.42
POLB P06746 2/20 0.42
GAA P10253 2/20 0.42
L3MBTL1 Q9Y468 1/20 0.42
KDM4E B2RXH2 7/20 0.41
KMT2A Q03164 5/20 0.41
GFER P55789 1/20 0.41
RXFP1 Q9HBX9 1/20 0.41
TDP1 Q9NUW8 4/20 0.40
MEN1 O00255 4/20 0.40
MAPT P10636 3/20 0.40
THRB P10828 3/20 0.40
USP2 O75604 2/20 0.40
PKM P14618 2/20 0.40
MCL1 Q07820 2/20 0.40
RECQL P46063 2/20 0.40
APEX1 P27695 1/20 0.40
BLM P54132 1/20 0.40

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
SCHEMBL18269486 0.86 ALDH1A1 (0.42) ALDH1A1HPGDPOLBGAAKDM4E
SCHEMBL16852603 0.78 PPM1B (0.54) IDO1ALDH1A1HPGDPOLBGAA
SCHEMBL15293570 0.78 KMT2A (0.66) IDO1ALDH1A1HPGDPOLBL3MBTL1
SCHEMBL987442 0.77 IDO1 (0.62) IDO1ALDH1A1HPGDPOLBGAA
SCHEMBL10001431 0.76 LCK (0.41) ALDH1A1HPGDGAAKDM4EMAPT
SCHEMBL12775042 0.75 ALDH1A1 (0.69) IDO1ALDH1A1HPGDPOLBGAA
SCHEMBL18159945 0.75 KMT2A (0.45) IDO1ALDH1A1HPGDPOLBGAA
SCHEMBL9271395 0.75 ALDH1A1 (0.51) IDO1ALDH1A1HPGDPOLBGAA
SCHEMBL29069489 0.75 IDO1 (0.60) IDO1ALDH1A1HPGDPOLBGAA
SCHEMBL12042662 0.73 ALDH1A1 (0.47) ALDH1A1HPGDPOLBGAAL3MBTL1

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-20150062519-A1 ALIGNMENT FILM, COMPOSITION FOR FORMING ALIGNMENT FILM AND LIQUID CRYSTAL DISPLAY DEVICE JAPAN DISPLAY INC (JP) 2015-03-05 US disclosed
US-8906474-B2 Alignment film, composition for forming alignment film and liquid crystal display device JAPAN DISPLAY INC. (JP) 2014-12-09 US disclosed
US-20120088040-A1 ALIGNMENT FILM, COMPOSITION FOR FORMING ALIGNMENT FILM AND LIQUID CRYSTAL DISPLAY DEVICE MAGNOLIA WHITE CORPORATION (JP) 2012-04-12 US disclosed