SCHEMBL1274569

SCHEMBL1274569

CC(=CC(C)P(=O)=O)C(N)=O

nearest known ligand 0.31

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 1/20 0.31
LMNA P02545 1/20 0.30
ALOX15 P16050 1/20 0.30
BLM P54132 1/20 0.30
PMP22 Q01453 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
SCHEMBL474263 0.79 PTGS1 (0.31)
Hydrochloric Acid SCHEMBL2357232 0.76 GABRP (0.36) TDP1LMNAALOX15BLMPMP22
SCHEMBL14952 0.75
SCHEMBL7193592 0.75 LMNA (0.37) TDP1LMNAALOX15BLMPMP22
SCHEMBL14950 0.75
SCHEMBL2487818 0.75 LMNA (0.37) TDP1LMNAALOX15BLMPMP22
SCHEMBL1345206 0.73
SCHEMBL471874 0.73
SCHEMBL11134868 0.73
SCHEMBL4347745 0.73

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8158561-B2 Scale and corrosion inhibitors for high temperature and pressure conditions ROHM AND HAAS COMPANY (US) 2012-04-17 US claimed
EP-2298704-A1 Scale and corrosion inhibitors for high temperature and pressure conditions Rohm and Haas Company (US) 2011-03-23 EP claimed
US-20110046023-A1 Scale and corrosion inhibitors for high temperature and pressure conditions ROHM AND HAAS COMPANY 2011-02-24 US claimed