SCHEMBL9403479

SCHEMBL9403479

CC=COc1ccc(C(=O)Oc2ccccc2)cc1

nearest known ligand 0.54

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
PARP10 Q53GL7 1/20 0.54
MAPT P10636 7/20 0.51
KMT2A Q03164 6/20 0.51
TDP1 Q9NUW8 3/20 0.51
ALDH1A1 P00352 3/20 0.51
L3MBTL1 Q9Y468 1/20 0.51
PKM P14618 1/20 0.51
SMN1; SMN2 Q16637 1/20 0.50
MEN1 O00255 3/20 0.49
TMPRSS15 P98073 2/20 0.49
RAB9A P51151 1/20 0.49
PRSS1 P07477 1/20 0.49
ACR P10323 1/20 0.49
NSD2 O96028 1/20 0.46
ELANE P08246 2/20 0.45
HPGD P15428 1/20 0.45

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
SCHEMBL8840350 0.92 MAPT (0.51) PARP10MAPTKMT2ATDP1ALDH1A1
SCHEMBL8972804 0.83 KMT2A (0.54) MAPTKMT2AALDH1A1L3MBTL1SMN1; SMN2
SCHEMBL27351314 0.82 ELANE (0.52) PARP10MAPTKMT2ATDP1ALDH1A1
SCHEMBL28649673 0.81 ELANE (0.58) MAPTALDH1A1L3MBTL1SMN1; SMN2RAB9A
SCHEMBL17468813 0.81 PARP10 (0.59) PARP10MAPTKMT2ATDP1ALDH1A1
SCHEMBL8205435 0.80 PARP10 (0.78) PARP10MAPTKMT2ATDP1ALDH1A1
SCHEMBL70034 0.80 PARP10 (0.70) PARP10MAPTKMT2ATDP1ALDH1A1
SCHEMBL11343755 0.80 CA1 (0.60) MAPTKMT2ATDP1ALDH1A1SMN1; SMN2
SCHEMBL6740579 0.79 CA1 (0.55) PARP10KMT2AALDH1A1PKMSMN1; SMN2
SCHEMBL9663679 0.78 PARP10 (0.81) PARP10MAPTKMT2ATDP1ALDH1A1

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-5301045-A Helical liquid crystalline element which produces linear polarized light CONSORTIUM FUR ELEKTROCHEMISCHE INDUSTRIE GMBH (DE) 1994-04-05 US disclosed