SCHEMBL9867476

SCHEMBL9867476

O=S(=O)(/N=C/N1CCOCC1)c1nc(-c2ccccc2)ns1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 6/20 0.49
KMT2A Q03164 6/20 0.49
ALDH1A1 P00352 5/20 0.45
NPC1 O15118 3/20 0.45
RAB9A P51151 3/20 0.45
HTT P42858 1/20 0.40
CNR2 P34972 1/20 0.39
MTOR P42345 1/20 0.38
MAPT P10636 2/20 0.38
MAPK1 P28482 2/20 0.38
NPSR1 Q6W5P4 2/20 0.38
TSHR P16473 2/20 0.38
HSD17B10 Q99714 1/20 0.38
POLB P06746 2/20 0.37
GAA P10253 2/20 0.37
CYP1A2 P05177 1/20 0.37
CYP2C9 P11712 1/20 0.37
CYP2C19 P33261 1/20 0.37
ATR Q13535 1/20 0.37
USP2 O75604 1/20 0.37

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
SCHEMBL9867483 1.00 MEN1 (0.49) MEN1KMT2AALDH1A1NPC1RAB9A
SCHEMBL9866057 0.85 MEN1 (0.44) MEN1KMT2AALDH1A1NPC1RAB9A
SCHEMBL9866060 0.85 MEN1 (0.44) MEN1KMT2AALDH1A1NPC1RAB9A
SCHEMBL28713848 0.75 KMT2A (0.74) MEN1KMT2AALDH1A1RAB9AHTT
SCHEMBL9867674 0.75 ADORA3 (0.41) ALDH1A1NPC1RAB9AHTTMAPT
SCHEMBL9869249 0.74 MAPT (0.41) MEN1KMT2AALDH1A1NPC1RAB9A
SCHEMBL9867775 0.73 LMNA (0.41) MEN1KMT2AALDH1A1NPC1RAB9A
SCHEMBL9866312 0.70 SMN1; SMN2 (0.40) MEN1KMT2AALDH1A1NPC1RAB9A
SCHEMBL28524587 0.68 KMT2A (0.55) MEN1KMT2AALDH1A1NPC1RAB9A
SCHEMBL28820221 0.66 KMT2A (0.73) MEN1KMT2AALDH1A1MAPTHSD17B10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4873239-A GLAUCOMA TREATMENT HOECHST-ROUSSEL PHARMACEUTICALS, INC. (US) 1989-10-10 US claimed
US-4985450-A TREATMENT OF GLAUCOMA AVENTIS PHARMACEUTICALS INC. 1991-01-15 US disclosed
US-4873239-A GLAUCOMA TREATMENT HOECHST-ROUSSEL PHARMACEUTICALS, INC. (US) 1989-10-10 US disclosed
EP-0276822-A1 Arylthiadiazolylsulfonamides and derivatives, a process for their preparation and their use as medicaments HOECHST-ROUSSEL PHARMACEUTICALS INCORPORATED (US) 1988-08-03 EP disclosed
US-4758578-A Arylthiadiazolylsulfonamides, pharmaceutical compositions and use HOECHST ROUSSEL PHARMACEUTICALS, INC. (US) 1988-07-19 US disclosed