SCHEMBL7724555

SCHEMBL7724555

CC(C)C(=O)Oc1ccc(S(=O)(=O)C(=[N+]=[N-])C(=O)C2CCCCC2)cc1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ELANE P08246 2/20 0.39
POLB P06746 2/20 0.35
HTT P42858 2/20 0.35
KMT2A Q03164 2/20 0.35
MAPT P10636 2/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
ALDH1A1 P00352 1/20 0.35
GAA P10253 1/20 0.35
ENPP3 O14638 2/20 0.35
ENPP1 P22413 2/20 0.35
ENPP2 Q13822 1/20 0.35
TSHR P16473 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
TDP1 Q9NUW8 1/20 0.35
MMP2 P08253 4/20 0.34
MMP1 P03956 2/20 0.34
MMP3 P08254 2/20 0.34
MMP9 P14780 1/20 0.34
MMP14 P50281 1/20 0.34
MMP7 P09237 1/20 0.34

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
SCHEMBL7722429 0.90 POLB (0.46) ELANEPOLBHTTKMT2AMAPT
SCHEMBL7721795 0.84 GLA (0.38) ELANEPOLBHTTKMT2AMAPT
SCHEMBL7696102 0.82 ENPP3 (0.52) POLBENPP3ENPP1ENPP2MMP2
SCHEMBL7721781 0.81 ELANE (0.40) ELANEPOLBHTTMAPTL3MBTL1
SCHEMBL7695448 0.81 ENPP3 (0.54) POLBKMT2AALDH1A1ENPP3ENPP1
SCHEMBL928962 0.80 ALDH1A1 (0.46) POLBHTTKMT2AMAPTALDH1A1
SCHEMBL7717492 0.80 ELANE (0.46) ELANEPOLBHTTKMT2AMAPT
SCHEMBL29904429 0.78 POLB (0.41) POLBKMT2AALDH1A1GAAENPP3
SCHEMBL7722363 0.77 ELANE (0.43) ELANEPOLBMAPTSMN1; SMN2TDP1
SCHEMBL8751838 0.77 ENPP3 (0.46) ALDH1A1GAAENPP3ENPP1ENPP2

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
US-6395446-B1 CONTAINING SULFONYLDIAZOMETHANE COMPOUND AS ACID GENERATOR SHIN-ETSU CHEMICAL CO., LTD. (JP) 2002-05-28 US disclosed