SCHEMBL28879265

SCHEMBL28879265

Cc1cccc(-n2nnnc2S)c1S(=O)(=O)O.[NaH]

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 10/20 0.38
TSHR P16473 3/20 0.38
HSD11B1 P28845 1/20 0.36
LMNA P02545 6/20 0.35
TP53 P04637 2/20 0.35
MAPT P10636 2/20 0.35
KDM4E B2RXH2 1/20 0.35
POLB P06746 1/20 0.35
APEX1 P27695 1/20 0.35
TDP1 Q9NUW8 1/20 0.35
HTT P42858 4/20 0.35
ALOX15 P16050 1/20 0.34
MAPK1 P28482 1/20 0.34
NPSR1 Q6W5P4 2/20 0.34
KCNN4 O15554 1/20 0.34
P2RX7 Q99572 3/20 0.33
SMN1; SMN2 Q16637 2/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
PTGS2 P35354 1/20 0.32
S1PR4 O95977 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
SCHEMBL28058425 0.77 ALDH1A1 (0.45) ALDH1A1TSHRHSD11B1LMNATP53
SCHEMBL1493484 0.76 ALDH1A1 (0.48) ALDH1A1TSHRHSD11B1LMNAKDM4E
SCHEMBL11638648 0.76 ALDH1A1 (0.62) ALDH1A1TSHRHSD11B1LMNATP53
SCHEMBL11686888 0.76 ALDH1A1 (0.46) ALDH1A1TSHRHSD11B1LMNATP53
SCHEMBL1537920 0.71 ALDH1A1 (0.43) ALDH1A1TSHRHSD11B1LMNAMAPT
SCHEMBL1493409 0.71 ALDH1A1 (0.56) ALDH1A1TSHRLMNAMAPTHTT
SCHEMBL8653708 0.70 ALDH1A1 (0.40) ALDH1A1TSHRLMNATP53MAPT
SCHEMBL11076120 0.70 ALDH1A1 (0.42) ALDH1A1TSHRTP53KDM4EPOLB
SCHEMBL1156164 0.69 LMNA (0.43) ALDH1A1TSHRLMNATP53MAPT
SCHEMBL28692287 0.68 ALDH1A1 (0.53) ALDH1A1TSHRLMNATP53MAPT

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-106458731-B Window thermal insulation film, window heat-protecting glass, construction material, window, building and the vehicles 富士胶片株式会社 2019-12-03 CN disclosed