SCHEMBL172184

SCHEMBL172184

O=C1c2ccccc2-c2ccccc2C1(c1ccccc1O)c1ccccc1O

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
S100A4 P26447 2/20 0.50
ALDH1A1 P00352 3/20 0.43
CA1 P00915 2/20 0.43
CA2 P00918 2/20 0.43
CA7 P43166 2/20 0.43
CA9 Q16790 2/20 0.43
RECQL P46063 2/20 0.43
L3MBTL1 Q9Y468 2/20 0.43
TSHR P16473 1/20 0.43
ALOX12 P18054 1/20 0.43
MAPK1 P28482 1/20 0.43
CASP1 P29466 1/20 0.43
BACE1 P56817 1/20 0.43
EHMT2 Q96KQ7 1/20 0.43
ESR1 P03372 3/20 0.42
ESR2 Q92731 3/20 0.42
HSP90AA1 P07900 2/20 0.41
HSP90AB1 P08238 2/20 0.41
MEN1 O00255 5/20 0.41
KMT2A Q03164 5/20 0.41

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
SCHEMBL13083282 0.90 S100A4 (0.44) S100A4ALDH1A1CA1CA2CA7
SCHEMBL30420925 0.88 S100A4 (0.61) S100A4ALDH1A1CA1CA2CA7
SCHEMBL20455698 0.88 S100A4 (0.61) S100A4ALDH1A1CA1CA2CA7
SCHEMBL30420962 0.88 S100A4 (0.61) S100A4ALDH1A1CA1CA2CA7
SCHEMBL29482233 0.83 ESR1 (0.50) S100A4ALDH1A1CA2RECQLL3MBTL1
SCHEMBL382439 0.83 ESR1 (0.50) S100A4ALDH1A1CA2RECQLL3MBTL1
SCHEMBL29646285 0.83 ESR1 (0.50) S100A4ALDH1A1CA2RECQLL3MBTL1
SCHEMBL31598409 0.81 S100A4 (0.58) S100A4ALDH1A1CA1CA2CA7
SCHEMBL8930207 0.80 MCL1 (0.48) ALDH1A1RECQLL3MBTL1TSHRALOX12
SCHEMBL171820 0.78 ESR1 (0.51) S100A4ALDH1A1CA1CA2CA7

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8283433-B2 Polycarbonate resin and electrophotographic photosensitive body using the same MITSUBISHI GAS CHEMICAL COMPANY, INC. (JP) 2012-10-09 US disclosed
EP-2048180-B1 POLYCARBONATE RESIN AND ELECTROPHOTOGRAPHIC PHOTOSENSITIVE BODY USING THE SAME MITSUBISHI GAS CHEMICAL CO (JP) 2012-03-07 EP disclosed
US-20100047703-A1 POLYCARBONATE RESIN AND ELECTROPHOTOGRAPHIC PHOTOSENSITIVE BODY USING THE SAME MITSUBISHI GAS CHEMICAL COMPANY, INC. (JP) 2010-02-25 US disclosed
EP-2048180-A1 POLYCARBONATE RESIN AND ELECTROPHOTOGRAPHIC PHOTOSENSITIVE BODY USING THE SAME MITSUBISHI GAS CHEMICAL COMPANY, INC. (JP) 2009-04-15 EP disclosed