SCHEMBL1228638

SCHEMBL1228638

CC(O)NC(N)=O.CC(O)NC(N)=O

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 1/20 0.40
ALDH1A1 P00352 1/20 0.40
LMNA P02545 4/20 0.37
TSHR P16473 3/20 0.37
NFKB1 P19838 2/20 0.37
BLM P54132 2/20 0.37
PMP22 Q01453 2/20 0.37
CA2 P00918 2/20 0.37
CA9 Q16790 2/20 0.37
CYP1A2 P05177 1/20 0.37
MAOA P21397 1/20 0.37
MAOB P27338 1/20 0.37
THPO P40225 1/20 0.37
CYP3A4 P08684 1/20 0.37
CA5A P35218 1/20 0.37
CRBN Q96SW2 1/20 0.36
TP53 P04637 1/20 0.35
CAD P27708 1/20 0.33
ALOX15 P16050 1/20 0.33
DPP4 P27487 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
SCHEMBL27662 1.00
SCHEMBL6872040 0.94 NPC1 (0.38) NPC1ALDH1A1LMNATSHRNFKB1
Acrylic Acid SCHEMBL28515783 0.83 LMNA (0.43) NPC1ALDH1A1LMNATSHRTP53
SCHEMBL1228635 0.78 CAD (0.32) NPC1ALDH1A1CAD
SCHEMBL24463 0.78
SCHEMBL4011389 0.78 LMNA (0.47) NPC1ALDH1A1LMNATSHRNFKB1
SCHEMBL1309454 0.77 NPC1 (0.38) NPC1ALDH1A1LMNATSHRNFKB1
SCHEMBL3267121 0.77
SCHEMBL1553525 0.77
SCHEMBL2039469 0.77

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2459606-A1 HYBRID COPOLYMER COMPOSITIONS Akzo Nobel N.V. (NL) 2012-06-06 EP disclosed
EP-2459607-A1 HYBRID COPOLYMER COMPOSITIONS FOR PERSONAL CARE APPLICATIONS Akzo Nobel N.V. (NL) 2012-06-06 EP disclosed
WO-2011017223-A1 HYBRID COPOLYMER COMPOSITIONS FOR PERSONAL CARE APPLICATIONS AKZO NOBEL N.V. (NL) 2011-02-10 WO disclosed
WO-2011014783-A1 HYBRID COPOLYMER COMPOSITIONS AKZO NOBEL N.V. (NL) 2011-02-03 WO disclosed