SCHEMBL28021699

SCHEMBL28021699

Nc1ncc(N)c(S(=O)(=O)c2ccccc2)n1

nearest known ligand 0.47

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
HTR6 P50406 2/20 0.46
FEN1 P39748 1/20 0.43
TP53 P04637 1/20 0.43
ALDH1A1 P00352 3/20 0.41
KDM4E B2RXH2 2/20 0.41
KMT2A Q03164 2/20 0.41
PIK3CA P42336 3/20 0.40
MAPT P10636 2/20 0.40
LMNA P02545 1/20 0.40
HTT P42858 1/20 0.40
NAMPT P43490 1/20 0.40
AKT1 P31749 2/20 0.40
POLB P06746 1/20 0.40
MEN1 O00255 1/20 0.40
RAB9A P51151 1/20 0.40
LOXL2 Q9Y4K0 1/20 0.40
MTOR P42345 1/20 0.39

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
SCHEMBL23718251 0.72 KDM4E (0.38) ALDH1A1KDM4EKMT2AMAPTMEN1
SCHEMBL5259568 0.71 KMT2A (0.73) HTR6FEN1TP53ALDH1A1KDM4E
SCHEMBL331646 0.70 HSP90AA1 (0.46) HTR6ALDH1A1KDM4EPIK3CAMAPT
SCHEMBL45909 0.69 HTR6 (0.59) HTR6TP53ALDH1A1KDM4EKMT2A
SCHEMBL6693894 0.69 HTR6 (0.59) HTR6TP53ALDH1A1KDM4EKMT2A
SCHEMBL6987361 0.66 TSHR (0.50) ALDH1A1KDM4EMAPTLMNAHTT
SCHEMBL11480360 0.66 KDM4E (0.58) HTR6KDM4ELMNANAMPT
(Phenylsulfonyl)Benzene SCHEMBL27791085 0.65 HTR6 (0.88) HTR6ALDH1A1MAPTLMNAPOLB
(Phenylsulfonyl)Benzene SCHEMBL13735236 0.65 HTR6 (1.00) HTR6ALDH1A1MAPTPOLB
(Phenylsulfonyl)Benzene SCHEMBL30255 0.65 HTR6 (1.00) HTR6ALDH1A1MAPTPOLB

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
CN-103137975-B Grapheme derivative material, preparation method of grapheme derivative material, and applications of grapheme derivative material OCEANS KING LIGHTING SCIENCE 2015-07-08 CN claimed
CN-103137975-B Grapheme derivative material, preparation method of grapheme derivative material, and applications of grapheme derivative material OCEANS KING LIGHTING SCIENCE 2015-07-08 CN disclosed