SCHEMBL9866060

SCHEMBL9866060

Cc1ccccc1-c1nsc(S(=O)(=O)N=CN2CCOCC2)n1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.44
KMT2A Q03164 1/20 0.44
ALDH1A1 P00352 6/20 0.40
TSHR P16473 4/20 0.40
CYP1A2 P05177 3/20 0.40
CYP3A4 P08684 3/20 0.40
CYP2C19 P33261 2/20 0.40
CLK4 Q9HAZ1 2/20 0.40
USP2 O75604 1/20 0.40
CYP2C9 P11712 1/20 0.40
ALOX15 P16050 1/20 0.40
MAPK1 P28482 1/20 0.40
CASP7 P55210 1/20 0.40
TDP1 Q9NUW8 2/20 0.38
LMNA P02545 2/20 0.38
CYP2D6 P10635 2/20 0.36
HSD17B10 Q99714 2/20 0.36
HIF1A Q16665 1/20 0.36
CNR2 P34972 1/20 0.36
MAPT P10636 3/20 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
SCHEMBL9866057 1.00 MEN1 (0.44) MEN1KMT2AALDH1A1TSHRCYP1A2
SCHEMBL9867476 0.85 MEN1 (0.49) MEN1KMT2AALDH1A1TSHRCYP1A2
SCHEMBL9867483 0.85 MEN1 (0.49) MEN1KMT2AALDH1A1TSHRCYP1A2
SCHEMBL9867104 0.77 LMNA (0.40) MEN1KMT2ATSHRCYP1A2CYP3A4
SCHEMBL10642641 0.74 L3MBTL1 (0.32) L3MBTL1
SCHEMBL9867475 0.70 CA1 (0.45) MEN1KMT2ACYP1A2CYP3A4CYP2C19
SCHEMBL9867020 0.69 L3MBTL1 (0.38) MEN1KMT2AALDH1A1TSHRCYP1A2
SCHEMBL9867674 0.69 ADORA3 (0.41) ALDH1A1CYP1A2CYP2C19CYP2C9ALOX15
SCHEMBL28713848 0.68 KMT2A (0.74) MEN1KMT2AALDH1A1TSHRLMNA
SCHEMBL28820221 0.68 KMT2A (0.73) MEN1KMT2AALDH1A1CYP3A4USP2

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