SCHEMBL1897282

SCHEMBL1897282

CCCC(C(N)=O)C(O)CCC(N)=O

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.38
ALOX15 P16050 1/20 0.38
BLM P54132 1/20 0.38
PMP22 Q01453 1/20 0.38
CA1 P00915 1/20 0.35
CA2 P00918 1/20 0.35
CYP3A4 P08684 3/20 0.33
SOAT1 P35610 2/20 0.33
MEN1 O00255 1/20 0.33
FAAH O00519 1/20 0.33
TP53 P04637 1/20 0.33
CYP1A2 P05177 1/20 0.33
CYP2C19 P33261 1/20 0.33
CHRM1 P11229 1/20 0.32
AKR1A1 P14550 1/20 0.32
CHRM3 P20309 1/20 0.32
HTR2A P28223 1/20 0.32
HTR2C P28335 1/20 0.32
ADRA1A P35348 1/20 0.32
HRH1 P35367 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
SCHEMBL3640967 0.76 CA1 (0.39) KMT2AALOX15BLMPMP22CA1
SCHEMBL27932621 0.73 GPR84 (0.50) KMT2ACYP3A4SOAT1MEN1FAAH
SCHEMBL21182210 0.72 CA1 (0.48) KMT2AALOX15BLMPMP22CA1
SCHEMBL6205731 0.72 CA1 (0.41) CA1CA2CYP3A4CHRM1AKR1A1
SCHEMBL6393563 0.72 KMT2A (0.44) KMT2AALOX15BLMPMP22CA1
SCHEMBL6204488 0.72 CA1 (0.41) CA1CA2CYP3A4CHRM1AKR1A1
SCHEMBL20197798 0.72 KMT2A (0.44) KMT2AALOX15BLMPMP22CA1
SCHEMBL1577891 0.72 CA1 (0.41) CA1CA2CYP3A4CHRM1AKR1A1
SCHEMBL23870286 0.70 ALOX15 (0.43) KMT2AALOX15BLMPMP22CA1
SCHEMBL4756999 0.70 TDP1 (0.48) CA1CA2CYP3A4CHRM1AKR1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2011057781-A2 COATING COMPOSITION FOR COATING FOOD CONTAINERS BE.BE. TECH S.R.L. (IT) 2011-05-19 WO disclosed