SCHEMBL9806941

SCHEMBL9806941

CC(C(=O)O)C(=O)OOP(=O)(OOC(=O)C(C)C(=O)O)OOC(=O)C(C)C(=O)O

nearest known ligand 0.43

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
TP53 P04637 1/20 0.32

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
SCHEMBL8712260 0.80 TP53 (0.42) TP53
SCHEMBL29224741 0.78 CTSA (0.31)
SCHEMBL24725871 0.73 TP53 (0.36) TP53
SCHEMBL21224308 0.70 PEPD (0.39) TP53
SCHEMBL36130 0.69 TP53 (0.42) TP53
SCHEMBL28336541 0.68 PEPD (0.38) TP53
SCHEMBL27881916 0.67 TP53 (0.40) TP53
SCHEMBL225761 0.67
SCHEMBL6296205 0.67
Methylmalonic Acid SCHEMBL28405076 0.66 TP53 (0.44) TP53

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4557934-A ALONG WITH A DIOL PYRROLIDONE OR AN AZACYCLOPENTAN-2-ONE THE PROCTER & GAMBLE COMPANY (US) 1985-12-10 US claimed
EP-0129285-B1 PENETRATING TOPICAL PHARMACEUTICAL COMPOSITIONS CONTAINING N-(2-HYDROXYETHYL)PYRROLIDONE THE PROCTER & GAMBLE COMPANY (US) 1991-05-15 EP disclosed
EP-0055239-B1 NOVEL DERIVATIVES OF GUANINE Astra Läkemedel Aktiebolag (SE) 1986-07-16 EP disclosed
EP-0103552-B1 NOVEL DERIVATIVES OF GUANINE Astra Läkemedel Aktiebolag (SE) 1986-05-07 EP disclosed
EP-0103551-B1 NOVEL DERIVATIVES OF GUANINE Astra Läkemedel Aktiebolag (SE) 1986-02-26 EP disclosed
US-4557934-A ALONG WITH A DIOL PYRROLIDONE OR AN AZACYCLOPENTAN-2-ONE THE PROCTER & GAMBLE COMPANY (US) 1985-12-10 US disclosed
US-4537776-A PERCUTANEOUS DELIVERY OF ANTIINFLAMMATORY AGENTS THE PROCTER & GAMBLE COMPANY (US) 1985-08-27 US disclosed
US-4495190-A VIRICIDES; ANTITUMOR AND ANTICARCINOGENIC AGENTS ASTRA LAKEMEDEL AKTIEBOLAG (SE) 1985-01-22 US disclosed
EP-0129285-A2 Penetrating topical pharmaceutical compositions containing N-(2-hydroxyethyl)pyrrolidone THE PROCTER & GAMBLE COMPANY (US) 1984-12-27 EP disclosed
EP-0129284-A2 Improved penetrating topical pharmaceutical compositions containing 1-dodecyl-azacycloheptan-2-one THE PROCTER & GAMBLE COMPANY (US) 1984-12-27 EP disclosed
EP-0112364-A1 NOVEL DERIVATIVES OF GUANINE II Astra Läkemedel Aktiebolag (SE) 1984-07-04 EP disclosed
EP-0112353-A1 NOVEL DERIVATIVES OF GUANINE I Astra Läkemedel Aktiebolag (SE) 1984-07-04 EP disclosed
EP-0103552-A2 Novel derivatives of guanine Astra Läkemedel Aktiebolag (SE) 1984-03-21 EP disclosed
EP-0103551-A2 Novel derivatives of guanine Astra Läkemedel Aktiebolag (SE) 1984-03-21 EP disclosed
WO-1984000168-A1 NOVEL DERIVATIVES OF GUANINE II ASTRA LAEKEMEDEL AB (SE) 1984-01-19 WO disclosed
WO-1984000167-A1 NOVEL DERIVATIVES OF GUANINE I ASTRA LAEKEMEDEL AB (SE) 1984-01-19 WO disclosed
EP-0095813-A2 Penetrating topical pharmaceutical compositions containing 9-(2-hydroxyethoxymethyl) guanine THE PROCTER & GAMBLE COMPANY (US) 1983-12-07 EP disclosed
WO-1982002202-A1 NOVEL DERIVATIVES OF GUANINE ASTRA LAEKEMEDEL AB (SE) 1982-07-08 WO disclosed
EP-0055239-A1 Novel derivatives of guanine Astra Läkemedel Aktiebolag (SE) 1982-06-30 EP disclosed