SCHEMBL8782843

SCHEMBL8782843

O=C(CCl)Oc1cc2ccccc2cc1O

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 3/20 0.41
KDM4E B2RXH2 3/20 0.41
MAPK1 P28482 1/20 0.41
MAPT P10636 2/20 0.41
KMT2A Q03164 2/20 0.41
MEN1 O00255 1/20 0.41
MITF O75030 1/20 0.41
NCOA1 Q15788 1/20 0.41
TDP1 Q9NUW8 1/20 0.41
NCOA3 Q9Y6Q9 1/20 0.41
ALDH1A1 P00352 2/20 0.41
CASP1 P29466 1/20 0.41
CASP7 P55210 1/20 0.41
TOP2A P11388 2/20 0.38
HPGD P15428 2/20 0.38
POLB P06746 1/20 0.37
NCEH1 Q6PIU2 1/20 0.37
IRAK4 Q9NWZ3 1/20 0.37
DRD2 P14416 1/20 0.37
DRD4 P21917 1/20 0.37

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
SCHEMBL6541925 0.80 MAPT (0.41) GAAKDM4EMAPK1MAPTKMT2A
SCHEMBL4644681 0.78 GAA (0.50) GAAKDM4EMAPTKMT2AALDH1A1
SCHEMBL2760999 0.78 HPGD (0.46) GAAKDM4EMAPTKMT2AMEN1
SCHEMBL7136988 0.77 KDM4E (0.50) GAAKDM4EMAPK1MAPTKMT2A
SCHEMBL11042130 0.77 KMT2A (0.39) GAAKDM4EMAPK1MAPTKMT2A
SCHEMBL6691255 0.77 TOP2A (0.45) KDM4EMAPK1MAPTKMT2AMEN1
SCHEMBL6346568 0.77 KDM4E (0.47) GAAKDM4EMAPK1MAPTKMT2A
SCHEMBL7135919 0.77 KMT2A (0.48) GAAKDM4EMAPTKMT2AMEN1
SCHEMBL11467623 0.75 KMT2A (0.56) KDM4EMAPTKMT2AMEN1NCOA1
SCHEMBL27499512 0.75 HPGD (0.43) GAAKDM4EMAPTKMT2AMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0560898-B1 PHOTOCHROMIC NAPHTHOPYRANS PPG INDUSTRIES INC (US) 1997-03-26 EP disclosed
US-5340857-A Ophthalmic lenses, plastic transparencies PPG INDUSTRIES, INC. (US) 1994-08-23 US disclosed
EP-0560898-A4 PHOTOCHROMIC NAPHTHOPYRANS 1993-11-18 EP disclosed
EP-0560898-A1 PHOTOCHROMIC NAPHTHOPYRANS. PPG INDUSTRIES INC (US) 1993-09-22 EP disclosed
US-5244602-A Photochromic articles comprising polymerized organic host material and naphthopyran PPG INDUSTRIES, INC. (US) 1993-09-14 US disclosed
WO-1992009593-A1 PHOTOCHROMIC NAPHTHOPYRANS PPG INDUSTRIES, INC. (US) 1992-06-11 WO disclosed