SCHEMBL7748221

SCHEMBL7748221

CC=C(NC(C)=O)C(N)=O

nearest known ligand 0.50

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
CRBN Q96SW2 1/20 0.50
TAS2R38 P59533 1/20 0.46
LMNA P02545 1/20 0.35
ALOX15 P16050 1/20 0.35
BLM P54132 1/20 0.35
PMP22 Q01453 1/20 0.35
TDP1 Q9NUW8 1/20 0.35
KDM4E B2RXH2 1/20 0.32
CA2 P00918 1/20 0.32
PTGS1 P23219 1/20 0.32
MMP12 P39900 1/20 0.32
NFKB1 P19838 1/20 0.30
EPHX1 P07099 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
SCHEMBL7743902 0.77 CRBN (0.42) CRBNTAS2R38
SCHEMBL14845210 0.77 TDP1 (0.46) CRBNTAS2R38TDP1
SCHEMBL978856 0.76
SCHEMBL7828104 0.76
SCHEMBL10408353 0.73 HRH2 (0.31)
SCHEMBL9475382 0.73 HRH2 (0.31)
SCHEMBL25741926 0.72
SCHEMBL21712558 0.72
SCHEMBL1408404 0.72
SCHEMBL2334069 0.72 ALDH1A1 (0.40) CRBNTAS2R38LMNATDP1KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6222083-B1 CONTACTING FLUID WITH INHIBITOR COMPRISING WATER-SOLUBLE POLYMER HAVING MONOMER UNITS SELECTED FROM ESTERS OF N-ACYLDEHYDROALANINE AND AMIDES OF N-ACYLDEHYDROALANINE FOR INHIBITING FORMATION CLATHRATE HYDRATES IN FLUID EXXONMOBIL UPSTREAM RESEARCH COMPANY 2001-04-24 US disclosed
WO-2001025372-A1 A METHOD FOR INHIBITING HYDRATE FORMATION EXXONMOBIL UPSTREAM RESEARCH COMPANY (US) 2001-04-12 WO disclosed