SCHEMBL28216045

SCHEMBL28216045

CC(OS(=O)(=O)Cc1ccccc1)c1cc(Cl)cc(Cl)c1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.42
MAPT P10636 2/20 0.37
ALDH1A1 P00352 1/20 0.37
RAB9A P51151 1/20 0.37
NPSR1 Q6W5P4 1/20 0.37
MEN1 O00255 1/20 0.37
HPGD P15428 1/20 0.37
IDO1 P14902 1/20 0.36
TDO2 P48775 1/20 0.36
PSEN1 P49768 1/20 0.36
PSEN2 P49810 1/20 0.36
APH1B Q8WW43 1/20 0.36
NCSTN Q92542 1/20 0.36
APH1A Q96BI3 1/20 0.36
PSENEN Q9NZ42 1/20 0.36
TACR1 P25103 1/20 0.36
CNR1 P21554 2/20 0.36
FAAH O00519 1/20 0.36
PRSS1 P07477 1/20 0.36
PRSS2 P07478 1/20 0.36

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
SCHEMBL4936620 0.76 KMT2A (0.55) KMT2AALDH1A1MEN1HPGDFAAH
SCHEMBL6916227 0.74 KMT2A (0.50) KMT2AALDH1A1MEN1HPGDFAAH
SCHEMBL28373028 0.74 HTT (0.59) KMT2AMAPTALDH1A1RAB9AMEN1
SCHEMBL28357823 0.74 KMT2A (0.53) KMT2AALDH1A1MEN1HPGDFAAH
SCHEMBL9507552 0.73 KMT2A (0.45) KMT2AALDH1A1MEN1HPGDFAAH
SCHEMBL28041171 0.73 KMT2A (0.52) KMT2AALDH1A1MEN1HPGDFAAH
SCHEMBL9040129 0.73 KMT2A (0.52) KMT2AALDH1A1MEN1HPGDFAAH
SCHEMBL27727049 0.73 S100A9 (0.36) ALDH1A1IDO1
SCHEMBL18243673 0.72 ALDH1A1 (0.39) KMT2AMAPTALDH1A1MEN1IDO1
SCHEMBL16726995 0.72 ALDH1A1 (0.39) KMT2AMAPTALDH1A1MEN1IDO1

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-105263490-B Substituted triazolopyridines and methods of use 基因泰克公司 2018-05-22 CN disclosed