SCHEMBL28337908

SCHEMBL28337908

CCCCCC(=O)OCCN=C=O.N=C=O.N=C=O.N=C=O.N=C=O

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DGKA P23743 1/20 0.56
PRSS1 P07477 1/20 0.49
PRSS2 P07478 1/20 0.49
PRSS3 P35030 1/20 0.49
DNM1 Q05193 1/20 0.47
PAM P19021 2/20 0.44
MAPT P10636 2/20 0.41
TSHR P16473 1/20 0.41
LMNA P02545 2/20 0.41
ALDH1A1 P00352 2/20 0.41
KDM4E B2RXH2 1/20 0.40
DUSP3 P51452 1/20 0.40
MEN1 O00255 1/20 0.40
KMT2A Q03164 1/20 0.40
HTR2C P28335 1/20 0.40
NAAA Q02083 1/20 0.40
MGLL Q99685 1/20 0.39
THRB P10828 1/20 0.38
CNR1 P21554 1/20 0.38
EPHX2 P34913 1/20 0.38

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
SCHEMBL9569406 0.95 DGKA (0.61) DGKAPRSS1PRSS2PRSS3DNM1
SCHEMBL15976529 0.94 DGKA (0.65) DGKAPRSS1PRSS2PRSS3DNM1
SCHEMBL15976528 0.90 DGKA (0.53) DGKAPRSS1PRSS2PRSS3DNM1
SCHEMBL15976519 0.83 DGKA (0.42) DGKAPRSS1PRSS2PRSS3DNM1
SCHEMBL28699927 0.83 DGKA (0.41) DGKAPRSS1PRSS2PRSS3DNM1
SCHEMBL10451645 0.83 DGKA (0.58) DGKAPRSS1PRSS2PRSS3DNM1
SCHEMBL11438853 0.83 DGKA (0.58) DGKAPRSS1PRSS2PRSS3DNM1
SCHEMBL4106139 0.82 DGKA (0.52) DGKAPRSS1PRSS2PRSS3DNM1
SCHEMBL1174146 0.82 DGKA (0.46) DGKAPRSS1PRSS2PRSS3DNM1
SCHEMBL11443788 0.81 DGKA (0.55) DGKAPRSS1PRSS2PRSS3DNM1

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
CN-105229536-B Toner, developer, image forming apparatus, and image forming method 株式会社理光 2019-12-24 CN disclosed