SCHEMBL8782851

SCHEMBL8782851

CC(=O)Oc1c(O)c(Cl)cc2ccccc12

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 5/20 0.49
▸ KDM4E B2RXH2 5/20 0.49
▸ HTT P42858 4/20 0.49
▸ GAA P10253 2/20 0.49
▸ HSD17B10 Q99714 2/20 0.49
▸ TP53 P04637 1/20 0.49
▸ ERN1 O75460 1/20 0.43
▸ ABCB11 O95342 1/20 0.41
▸ ALDH1A1 P00352 5/20 0.41
▸ TDP1 Q9NUW8 3/20 0.41
▸ KMT2A Q03164 3/20 0.41
▸ MEN1 O00255 2/20 0.41
▸ NPSR1 Q6W5P4 2/20 0.41
▸ RAB9A P51151 1/20 0.41
▸ POLB P06746 2/20 0.40
▸ TSHR P16473 1/20 0.40
▸ BACE1 P56817 1/20 0.40
▸ PDE4A P27815 1/20 0.39
▸ PDE4B Q07343 1/20 0.39
▸ PDE4C Q08493 1/20 0.39

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
SCHEMBL4752091 0.81 KDM4E (0.54) MAPTKDM4EHTTGAAHSD17B10
SCHEMBL11205633 0.80 ERN1 (0.42) MAPTKDM4EHTTHSD17B10TP53
SCHEMBL6755866 0.76 KDM4E (0.58) MAPTKDM4EHTTGAAHSD17B10
SCHEMBL6227217 0.76 HTT (0.54) MAPTKDM4EHTTGAAHSD17B10
SCHEMBL8582319 0.76 KDM4E (0.59) MAPTKDM4EHTTGAAHSD17B10
SCHEMBL8107317 0.74 KDM4E (0.50) MAPTKDM4EHTTGAAHSD17B10
SCHEMBL30447095 0.74 ERN1 (0.42) MAPTKDM4EHTTHSD17B10TP53
SCHEMBL3912774 0.74 KDM4E (0.46) MAPTKDM4EHTTGAAHSD17B10
SCHEMBL5675873 0.73 KDM4E (0.54) MAPTKDM4EHTTGAAHSD17B10
SCHEMBL9430129 0.73 HTT (0.57) MAPTKDM4EHTTGAAHSD17B10

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
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