SCHEMBL19166259

SCHEMBL19166259

CCOc1nc(C)nc(OCO)n1

nearest known ligand 0.38

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 3/20 0.38
KMT2A Q03164 3/20 0.38
CYP1A2 P05177 1/20 0.38
TSHR P16473 2/20 0.37
ALDH1A1 P00352 2/20 0.37
L3MBTL1 Q9Y468 1/20 0.37
POLB P06746 1/20 0.36
PDE4B Q07343 1/20 0.35
PDE4D Q08499 1/20 0.35
MAT2A P31153 1/20 0.34
MAPK1 P28482 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
HPGD P15428 1/20 0.32
CA1 P00915 2/20 0.32
CA2 P00918 2/20 0.32
CA9 Q16790 2/20 0.32
LMNA P02545 2/20 0.31
MAPT P10636 1/20 0.30

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
SCHEMBL20202489 0.89 MEN1 (0.45) MEN1KMT2ACYP1A2TSHRALDH1A1
SCHEMBL10328390 0.84 MEN1 (0.45) MEN1KMT2ACYP1A2TSHRALDH1A1
SCHEMBL582039 0.78 MEN1 (0.52) MEN1KMT2ACYP1A2TSHRALDH1A1
SCHEMBL6008241 0.78 POLB (0.41) POLBMAPK1
SCHEMBL1131137 0.74 HSP90AA1 (0.44) MEN1KMT2ACYP1A2TSHRALDH1A1
SCHEMBL9433260 0.74 POLB (0.40) MEN1KMT2ACYP1A2TSHRALDH1A1
SCHEMBL9294465 0.74 PDE4B (0.39) MEN1KMT2ACYP1A2TSHRALDH1A1
SCHEMBL19166260 0.73 SLC29A1 (0.42) KMT2ACYP1A2ALDH1A1L3MBTL1POLB
SCHEMBL632491 0.72 MEN1 (0.43) MEN1KMT2ACYP1A2TSHRALDH1A1
SCHEMBL10672222 0.71 MEN1 (0.48) MEN1KMT2ACYP1A2ALDH1A1L3MBTL1

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-10041001-B2 Liquid crystal composition, liquid crystal display device including the same, and method of manufacturing liquid crystal display device SAMSUNG DISPLAY CO., LTD. (KR) 2018-08-07 US disclosed
US-20170210994-A1 LIQUID CRYSTAL COMPOSITION, LIQUID CRYSTAL DISPLAY DEVICE INCLUDING THE SAME, AND METHOD OF MANUFACTURING LIQUID CRYSTAL DISPLAY DEVICE TCL CHINA STAR OPTOELECTRONICS TECHNOLOGY CO., LTD. (CN) 2017-07-27 US disclosed
US-20170210993-A1 LIQUID CRYSTAL COMPOSITION, LIQUID CRYSTAL DISPLAY DEVICE INCLUDING THE SAME, AND METHOD OF MANUFACTURING LIQUID CRYSTAL DISPLAY DEVICE TCL CHINA STAR OPTOELECTRONICS TECHNOLOGY CO., LTD. (CN) 2017-07-27 US disclosed