SCHEMBL5178185

SCHEMBL5178185

CCCCN(CCCC)CC(=O)OC(C)=O

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA12 O43570 2/20 0.41
CA1 P00915 2/20 0.41
CA9 Q16790 2/20 0.41
NAAA Q02083 1/20 0.39
ALDH1A1 P00352 3/20 0.39
DNM1 Q05193 1/20 0.37
THRA P10827 1/20 0.36
THRB P10828 1/20 0.36
DGKA P23743 1/20 0.35
KDM5A P29375 4/20 0.35
TSHR P16473 1/20 0.35
MMP1 P03956 1/20 0.34
MMP2 P08253 1/20 0.34
MMP3 P08254 1/20 0.34
MMP8 P22894 1/20 0.34
LMNA P02545 1/20 0.34
CYP1A2 P05177 1/20 0.34
CHRM2 P08172 1/20 0.34
CYP3A4 P08684 1/20 0.34
HTR1A P08908 1/20 0.34

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
SCHEMBL25430083 0.90 CA12 (0.45) CA12CA1CA9NAAAALDH1A1
SCHEMBL27960331 0.88 ALDH1A1 (0.38) CA12CA1CA9NAAAALDH1A1
SCHEMBL7171039 0.86 CA12 (0.42) CA12CA1CA9NAAAALDH1A1
SCHEMBL103304 0.79 OPRK1 (0.42) CA12CA1CA9ALDH1A1TSHR
SCHEMBL28214916 0.78 ALDH1A1 (0.50) CA12CA1CA9NAAAALDH1A1
SCHEMBL23270362 0.78 CA12 (0.50) CA12CA1CA9NAAAALDH1A1
SCHEMBL28214909 0.78 DNM1 (0.46) CA12CA1CA9NAAAALDH1A1
SCHEMBL28546833 0.77 NAAA (0.46) NAAAALDH1A1DNM1DGKAKDM5A
SCHEMBL5242147 0.77 TSHR (0.37) CA12CA1CA9NAAAALDH1A1
SCHEMBL27517384 0.77 AKR1B1 (0.48) ALDH1A1DNM1KDM5ATSHRKDM4C

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
EP-0992490-B2 Flowable formed methionine products and method for producing the same DEGUSSA (DE) 2007-08-29 EP claimed
EP-0992490-B1 Flowable formed methionine products and method for producing the same DEGUSSA (DE) 2003-05-28 EP claimed