SCHEMBL8470167

SCHEMBL8470167

C=CCC(CO)OCC(O)CO

nearest known ligand 0.32

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.32
ALDH1A1 P00352 1/20 0.32
CA1 P00915 1/20 0.31
CA2 P00918 1/20 0.31
CA7 P43166 1/20 0.31
KDM4E B2RXH2 1/20 0.30
DUSP3 P51452 1/20 0.30
MEN1 O00255 1/20 0.30
KMT2A Q03164 1/20 0.30

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
SCHEMBL882914 0.79 LMNA (0.44) LMNAALDH1A1KDM4EDUSP3MEN1
SCHEMBL3229826 0.79 CA1 (0.48) CA1CA2CA7
SCHEMBL20455856 0.78 ALDH1A1 (0.31) LMNAALDH1A1CA1CA2CA7
SCHEMBL9816264 0.76 CA1 (0.50) CA1CA2CA7
SCHEMBL3264113 0.76
SCHEMBL1656775 0.76 TSHR (0.30) CA1CA2CA7
SCHEMBL30390130 0.74 CA1 (0.49) CA1CA2CA7
SCHEMBL8956977 0.74
SCHEMBL25418338 0.73 KDM4E (0.30) LMNAKDM4EDUSP3MEN1KMT2A
SCHEMBL15025253 0.73 CA1 (0.52) CA1CA2CA7

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
WO-2018211061-A1 ADDITIVES FOR ELIMINATING FRACTURING FLUIDS USED FOR OIL EXTRACTION RHODIA OPERATIONS (FR) 2018-11-22 WO claimed
WO-2018211061-A1 ADDITIVES FOR ELIMINATING FRACTURING FLUIDS USED FOR OIL EXTRACTION RHODIA OPERATIONS (FR) 2018-11-22 WO disclosed
EP-0560001-B1 High active detergent pastes PROCTER & GAMBLE (US) 1999-05-19 EP disclosed
US-5529722-A MIXTURE OF CARBON 12-20 ALKYL SULFATE, ALKYL ETHOXY SULFATE AND WATER; CONTINUOUS NEUTRALIZATION OF ANIONIC SURFACTANT IN A NEUTRALIZATION LOOP WITH ALKALI METAL, ADDING ETHOXY ALKYL SULFONATE AFTER NEUTRALIZATION THE PROCTER & GAMBLE COMPANY (US) 1996-06-25 US disclosed
WO-1993018123-A1 HIGH ACTIVE DETERGENT PASTES THE PROCTER & GAMBLE COMPANY (US) 1993-09-16 WO disclosed
EP-0560001-A1 High active detergent pastes THE PROCTER & GAMBLE COMPANY (US) 1993-09-15 EP disclosed