SCHEMBL12245608

SCHEMBL12245608

CC1=NN(c2ccc(SOOO)cc2)C(=O)/C1=C\c1c(C)nn(-c2ccc(S(=O)(=O)O)cc2)c1O

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KAT8 Q9H7Z6 4/20 0.48
▸ ALDH1A1 P00352 6/20 0.45
▸ HPGD P15428 2/20 0.45
▸ HSD17B10 Q99714 1/20 0.45
▸ PTGS2 P35354 4/20 0.40
▸ MAPT P10636 7/20 0.38
▸ MEN1 O00255 4/20 0.38
▸ KMT2A Q03164 4/20 0.38
▸ POLB P06746 2/20 0.38
▸ GAA P10253 1/20 0.38
▸ TDP1 Q9NUW8 3/20 0.36
▸ MAPK1 P28482 2/20 0.36
▸ HTT P42858 1/20 0.36
▸ L3MBTL1 Q9Y468 1/20 0.36
▸ AMY1A P0DUB6 1/20 0.36
▸ LMNA P02545 1/20 0.35
▸ THRB P10828 1/20 0.35
▸ RAB9A P51151 1/20 0.35
▸ GALK1 P51570 1/20 0.35
▸ BLM P54132 1/20 0.35

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
SCHEMBL14197580 0.90 CA1 (0.44) KAT8ALDH1A1HPGDHSD17B10PTGS2
SCHEMBL14493700 0.89 KAT8 (0.59) KAT8ALDH1A1HPGDHSD17B10PTGS2
SCHEMBL6680163 0.89 KAT8 (0.59) KAT8ALDH1A1HPGDHSD17B10PTGS2
SCHEMBL6680153 0.89 KAT8 (0.59) KAT8ALDH1A1HPGDHSD17B10PTGS2
Ammonia Solution, Strong SCHEMBL7049465 0.88 KAT8 (0.58) KAT8ALDH1A1HPGDHSD17B10PTGS2
Ammonia Solution, Strong SCHEMBL6684527 0.88 KAT8 (0.58) KAT8ALDH1A1HPGDHSD17B10PTGS2
SCHEMBL16232414 0.85 KAT8 (0.58) KAT8ALDH1A1HPGDHSD17B10MAPT
SCHEMBL13232305 0.80 PTGS2 (0.33) KAT8ALDH1A1HPGDHSD17B10PTGS2
SCHEMBL18873553 0.79 MAPT (0.42) KAT8ALDH1A1HPGDPTGS2MAPT
SCHEMBL6680116 0.78 CA1 (0.53) KAT8ALDH1A1HPGDHSD17B10PTGS2

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
US-8012676-B2 Process for preparing conductive material MITSUBISHI PAPER MILLS LIMITED (JP) 2011-09-06 — — US disclosed
US-20090233237-A1 Process For Preparing Conductive Material MITSUBISHI PAPER MILLS LIMITED (JP) 2009-09-17 — — US disclosed
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