SCHEMBL8734150

SCHEMBL8734150

O=[N+]([O-])c1ccccc1SSc1ccccc1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDE7A Q13946 3/20 0.51
SMN1; SMN2 Q16637 2/20 0.51
MAPT P10636 6/20 0.46
ALDH1A1 P00352 4/20 0.46
MEN1 O00255 3/20 0.46
KMT2A Q03164 3/20 0.46
GAA P10253 3/20 0.46
KDM4E B2RXH2 1/20 0.46
HSD17B10 Q99714 2/20 0.46
HPGD P15428 1/20 0.46
MGLL Q99685 1/20 0.46
PDE7B Q9NP56 1/20 0.46
TDP1 Q9NUW8 3/20 0.46
LMNA P02545 2/20 0.45
ALPG P10696 1/20 0.45
L3MBTL1 Q9Y468 1/20 0.45
PKM P14618 1/20 0.45
KDM4A O75164 1/20 0.45
TDP2 O95551 1/20 0.45
KDM4C Q9H3R0 1/20 0.45

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
SCHEMBL224666 0.90 PDE7A (0.60) PDE7ASMN1; SMN2MAPTALDH1A1MEN1
SCHEMBL27271638 0.88 HSD17B10 (0.55) PDE7ASMN1; SMN2MAPTALDH1A1MEN1
SCHEMBL7643345 0.86 GPR35 (0.47) PDE7ASMN1; SMN2MAPTALDH1A1MEN1
SCHEMBL7758949 0.86 PDE7A (0.54) PDE7ASMN1; SMN2MAPTALDH1A1MEN1
SCHEMBL1713219 0.82 PDE7A (0.65) PDE7ASMN1; SMN2MAPTALDH1A1MEN1
SCHEMBL30338244 0.82 PDE7A (0.65) PDE7ASMN1; SMN2MAPTALDH1A1MEN1
SCHEMBL11027382 0.82 PDE7A (0.56) PDE7ASMN1; SMN2MAPTALDH1A1MEN1
SCHEMBL11209984 0.82 PDE7A (0.56) PDE7ASMN1; SMN2MAPTALDH1A1MEN1
SCHEMBL11319431 0.80 PDE7A (0.55) PDE7ASMN1; SMN2MAPTALDH1A1MEN1
SCHEMBL8989706 0.80 PDE7A (0.51) PDE7ASMN1; SMN2MAPTALDH1A1MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0756611-B1 PREPARATION PROCESS FOR POLYMER-MODIFIED BITUMEN SHELL INT RESEARCH (NL) 1998-03-04 EP claimed
EP-0156769-B1 PROCESS FOR THE MANUFACTURE OF NITRO DIPHENNYL DISULPHIDES CIBA-GEIGY AG (CH) 1987-05-20 EP claimed
US-4618721-A Process for the preparation of nitrodiphenyl disulfides CIBA-GEIGY CORPORATION (US) 1986-10-21 US claimed
EP-0156769-A1 Process for the manufacture of nitro diphennyl disulphides CIBA-GEIGY AG (CH) 1985-10-02 EP claimed
EP-0156769-B1 PROCESS FOR THE MANUFACTURE OF NITRO DIPHENNYL DISULPHIDES CIBA-GEIGY AG (CH) 1987-05-20 EP disclosed
EP-0156769-B1 PROCESS FOR THE MANUFACTURE OF NITRO DIPHENNYL DISULPHIDES CIBA-GEIGY AG (CH) 1987-05-20 EP disclosed
US-4618721-A Process for the preparation of nitrodiphenyl disulfides CIBA-GEIGY CORPORATION (US) 1986-10-21 US disclosed
US-4618721-A Process for the preparation of nitrodiphenyl disulfides CIBA-GEIGY CORPORATION (US) 1986-10-21 US disclosed
US-4618721-A Process for the preparation of nitrodiphenyl disulfides CIBA-GEIGY CORPORATION (US) 1986-10-21 US disclosed
EP-0156769-A1 Process for the manufacture of nitro diphennyl disulphides CIBA-GEIGY AG (CH) 1985-10-02 EP disclosed
EP-0156769-A1 Process for the manufacture of nitro diphennyl disulphides CIBA-GEIGY AG (CH) 1985-10-02 EP disclosed
EP-0156769-A1 Process for the manufacture of nitro diphennyl disulphides CIBA-GEIGY AG (CH) 1985-10-02 EP disclosed