SCHEMBL7652745

SCHEMBL7652745

CCCc1csc(S(N)(=O)=O)c1-c1ccccc1

nearest known ligand 0.38

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
CA2 P00918 9/20 0.38
CA9 Q16790 7/20 0.38
CA1 P00915 6/20 0.38
CA12 O43570 3/20 0.36
LMNA P02545 2/20 0.35
RAB9A P51151 2/20 0.35
PTGS2 P35354 1/20 0.35
MEN1 O00255 2/20 0.35
KMT2A Q03164 2/20 0.35
SREBF2 Q12772 1/20 0.35
MAPK1 P28482 1/20 0.35
HTT P42858 2/20 0.34
CDK8 P49336 1/20 0.34
ACVR1 Q04771 1/20 0.34
ELANE P08246 1/20 0.34
CTSG P08311 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
MAPT P10636 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
SCHEMBL4789670 0.81 PTGS2 (0.41) CA2CA9CA1CA12PTGS2
SCHEMBL4760307 0.76 CA1 (0.41) CA2CA9CA1CA12LMNA
SCHEMBL5652598 0.68 CA2 (0.44) CA2CA9CA1CA12ELANE
SCHEMBL17363903 0.68 KDM4E (0.34) CA2CA9CA1LMNAMEN1
SCHEMBL30513622 0.67 CA2 (0.52) CA2CA9CA1CA12PTGS2
SCHEMBL7652735 0.67 ELANE (0.37) CA2CA9CA1CA12RAB9A
Biphenyl SCHEMBL19409340 0.66 CA1 (0.54) CA2CA9CA1CA12RAB9A
SCHEMBL301797 0.66 CA2 (0.47) CA2CA9CA1CA12
SCHEMBL4760304 0.66 CA1 (0.42) CA2CA9CA1CA12LMNA
Hydrochloric Acid SCHEMBL7362559 0.65 CA2 (0.45) CA2CA9CA1CA12

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-6432994-B1 CARDIOVASCULAR DISORDERS, GLAUCOMA; ANTIINFLAMMATORY, WOUND HEALING, HYPOTENSIVE, ANTIASTHMATIC, AND ANTIANAPHYLACTIC AGENTS TEXAS BIOTECHNOLOGY CORPORATION 2002-08-13 US disclosed