SCHEMBL9404002

SCHEMBL9404002

[N-]=[N+]=C(C(=O)CCc1ccc(Cl)c(S(=O)(=O)Cl)c1)C(=O)CCc1ccc(Cl)c(S(=O)(=O)Cl)c1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PLAAT3 P53816 2/20 0.37
PLAAT5 Q96KN8 2/20 0.37
PLAAT2 Q9NWW9 2/20 0.37
PLAAT4 Q9UL19 2/20 0.37
PYGL P06737 1/20 0.35
GSTO1 P78417 2/20 0.35
CA1 P00915 5/20 0.34
CA2 P00918 5/20 0.34
ALDH1A1 P00352 3/20 0.33
PDPK1 O15530 1/20 0.33
GRIN1 Q05586 1/20 0.33
GRIN2B Q13224 1/20 0.33
LMNA P02545 1/20 0.33
POLB P06746 1/20 0.32
TDP1 Q9NUW8 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.32
MAPT P10636 1/20 0.32
RAB9A P51151 1/20 0.32
CA12 O43570 1/20 0.32
CA9 Q16790 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
SCHEMBL9403996 0.85 ALDH1A1 (0.35) PLAAT3PLAAT5PLAAT2PLAAT4CA1
SCHEMBL9404006 0.82 ALOX5 (0.39) CA1CA2ALDH1A1LMNAPOLB
SCHEMBL456926 0.80 ALDH1A1 (0.44) PLAAT3PLAAT5PLAAT2PLAAT4CA1
SCHEMBL9404004 0.76 POLB (0.43) PLAAT3PLAAT5PLAAT2PLAAT4CA1
Ammonia Solution, Strong SCHEMBL9404030 0.75 POLB (0.42) PLAAT3PLAAT5PLAAT2PLAAT4CA1
SCHEMBL9403974 0.75 PLAAT3 (0.57) PLAAT3PLAAT5PLAAT2PLAAT4ALDH1A1
SCHEMBL9404018 0.74 ALDH1A1 (0.39) PLAAT3PLAAT5PLAAT2PLAAT4CA1
SCHEMBL9404011 0.74 ALDH1A1 (0.46) PLAAT3PLAAT5PLAAT2PLAAT4CA1
SCHEMBL9404052 0.74 ALDH1A1 (0.46) PLAAT3PLAAT5PLAAT2PLAAT4CA1
SCHEMBL9404022 0.73 LMNA (0.38) ALDH1A1LMNAPOLBTDP1MAPT

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0323050-B1 Photosensitive compound WAKO PURE CHEM IND LTD (JP) 1994-11-02 EP disclosed
US-5250669-A Thermostability, photoresists WAKO PURE CHEMICAL INDUSTRIES, LTD. (JP) 1993-10-05 US disclosed
EP-0323050-A2 Photosensitive compound WAKO PURE CHEMICAL INDUSTRIES LTD (JP) 1989-07-05 EP disclosed