SCHEMBL7526044

SCHEMBL7526044

CCOP(=O)([CH]P(=O)(OCC)OCC)OCC

nearest known ligand 0.56

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.56
TP53 P04637 1/20 0.50
TDP1 Q9NUW8 1/20 0.50
PPARD Q03181 2/20 0.42
NPSR1 Q6W5P4 1/20 0.39
ACHE P22303 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
SCHEMBL7525419 0.84 TSHR (0.42) TSHRTP53TDP1PPARDNPSR1
SCHEMBL5015252 0.84 TSHR (0.53) TSHRTP53TDP1PPARDNPSR1
SCHEMBL6631037 0.81 TSHR (0.50) TSHRTP53TDP1PPARDNPSR1
SCHEMBL1396448 0.81 TSHR (0.50) TSHRTP53TDP1PPARDNPSR1
SCHEMBL5357461 0.79 TSHR (0.48) TSHRTP53TDP1PPARDNPSR1
SCHEMBL17915493 0.79 TSHR (0.48) TSHRTP53TDP1PPARDNPSR1
SCHEMBL4797316 0.79 TSHR (0.48) TSHRTP53TDP1PPARDNPSR1
SCHEMBL19837991 0.79 TSHR (0.48) TSHRTP53TDP1PPARDNPSR1
SCHEMBL7991304 0.79 TSHR (0.48) TSHRTP53TDP1PPARDNPSR1
SCHEMBL282682 0.79 TSHR (0.48) TSHRTP53TDP1PPARDNPSR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1179529-A1 NOVEL HYDROXAMIC ACID DERIVATIVES Daiichi Fine Chemical Co., Ltd. (JP) 2002-02-13 EP claimed
EP-1038864-A1 NOVEL METALLOPROTEINASE INHIBITORS FUJI YAKUHIN KOGYO KABUSHIKI KAISHA (JP) 2000-09-27 EP claimed
EP-1179529-A1 NOVEL HYDROXAMIC ACID DERIVATIVES Daiichi Fine Chemical Co., Ltd. (JP) 2002-02-13 EP disclosed
EP-1101492-A1 NOVEL REMEDIES FOR ALLERGIC DISEASES FUJI YAKUHIN KOGYO KABUSHIKI KAISHA (JP) 2001-05-23 EP disclosed
EP-1038864-A1 NOVEL METALLOPROTEINASE INHIBITORS FUJI YAKUHIN KOGYO KABUSHIKI KAISHA (JP) 2000-09-27 EP disclosed