SCHEMBL6559999

SCHEMBL6559999

COc1ccc2c(c1)OC(C)(C)C(NS(C)(=O)=O)C2

nearest known ligand 0.45

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
HIF1A Q16665 5/20 0.45
CA2 P00918 4/20 0.40
ACHE P22303 3/20 0.40
CA1 P00915 2/20 0.40
ABCB1 P08183 2/20 0.39
MTNR1A P48039 5/20 0.38
MTNR1B P49286 3/20 0.38
CA5A P35218 1/20 0.37
HTR2C P28335 1/20 0.37
DRD2 P14416 1/20 0.36
DRD3 P35462 1/20 0.36

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
SCHEMBL6561204 0.88 HIF1A (0.44) HIF1ACA2ACHECA1ABCB1
SCHEMBL11386682 0.74 HIF1A (0.52) HIF1ACA2MTNR1AMTNR1BCA5A
SCHEMBL6592058 0.70 HIF1A (0.50) HIF1A
SCHEMBL6594263 0.70 CA1 (0.48) HIF1ACA2CA1
SCHEMBL224104 0.69 HIF1A (0.45) HIF1AABCB1HTR2CDRD2DRD3
SCHEMBL225757 0.68 HIF1A (0.44) HIF1ADRD3
SCHEMBL14327006 0.67 HIF1A (0.46) HIF1AACHE
SCHEMBL16109188 0.67 CA2 (0.44) HIF1ACA2CA5AHTR2CDRD2
SCHEMBL16745489 0.66 DRD2 (0.40) HIF1ACA2ACHEMTNR1ACA5A
SCHEMBL11295099 0.66 MTNR1A (0.55) CA2ACHECA1MTNR1AMTNR1B

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-0807629-B1 Sulfonamido substituted chromane derivatives, method for their preparation, their use as medicaments or diagnostic agents aswell as medicaments containing them AVENTIS PHARMA GMBH (DE) 2004-03-03 EP disclosed
US-6191164-B1 POTASSIUM CHANNEL MODULATORS; ANTIULCER AGENTS HOECHST AKTIENGESELLSCHAFT (DE) 2001-02-20 US disclosed
EP-0807629-A1 Sulfonamido substituted chromane derivatives, method for their preparation, their use as medicaments or diagnostic agents aswell as medicaments containing them HOECHST AKTIENGESELLSCHAFT (DE) 1997-11-19 EP disclosed