SCHEMBL14944760

SCHEMBL14944760

OCOc1cc(OCO)cc(OCO)c1

nearest known ligand 0.33

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.33
MAPT P10636 1/20 0.33
MEN1 O00255 1/20 0.32
KMT2A Q03164 1/20 0.32
RECQL P46063 1/20 0.32
PLA2G2A P14555 1/20 0.31
INPPL1 O15357 1/20 0.30
INPP5A Q14642 1/20 0.30
TSHR P16473 1/20 0.30
MAPK1 P28482 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
SCHEMBL2097718 0.86 ALDH1A1 (0.58) ALDH1A1KMT2ATSHRMAPK1
SCHEMBL716796 0.82 TSHR (0.47) ALDH1A1MEN1KMT2ARECQLTSHR
SCHEMBL2097313 0.80 MAPT (0.38) ALDH1A1MAPT
SCHEMBL18116610 0.80 SOD1 (0.42)
SCHEMBL2094046 0.80 MAPT (0.48) MAPTTSHR
SCHEMBL2089727 0.78 CES2 (0.37)
SCHEMBL3058241 0.78 ALDH1A1 (0.44) ALDH1A1MAPTMEN1KMT2ARECQL
SCHEMBL2097371 0.74 SOD1 (0.47) ALDH1A1MAPT
SCHEMBL13154651 0.74 KMT2A (0.53) ALDH1A1MAPTMEN1KMT2APLA2G2A
SCHEMBL5378158 0.73 ALDH1A1 (0.59) ALDH1A1RECQLPLA2G2ATSHRMAPK1

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
EP-3192801-A1 PEPTIDES DERIVATIVES Bicycle Therapeutics Limited (GB) 2017-07-19 EP disclosed
US-9217109-B2 Polymer-stabilised liquid-crystal media and displays MERCK PATENT GMBH (DE) 2015-12-22 US disclosed
US-20130119311-A1 POLYMER-STABILISED LIQUID-CRYSTAL MEDIA AND DISPLAYS MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 2013-05-16 US disclosed