SCHEMBL8665535

SCHEMBL8665535

Cc1cc(F)c(S(=O)(=O)Cl)cc1S(=O)(=O)Cl

nearest known ligand 0.36

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
TRPV4 Q9HBA0 2/20 0.32
RAPGEF4 Q8WZA2 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.31
POLB P06746 1/20 0.30
GAA P10253 1/20 0.30
SMN1; SMN2 Q16637 1/20 0.30
CCR2 P41597 1/20 0.30

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
SCHEMBL17056174 0.89 PTGS2 (0.33) TRPV4RAPGEF4L3MBTL1POLBGAA
SCHEMBL14902115 0.87 RAPGEF4 (0.35) TRPV4RAPGEF4L3MBTL1POLBGAA
SCHEMBL9339232 0.84 RAPGEF4 (0.41) TRPV4RAPGEF4L3MBTL1POLBGAA
SCHEMBL16784556 0.83 TRPV4 (0.38) TRPV4SMN1; SMN2
SCHEMBL1094769 0.83 TRPV4 (0.32) TRPV4RAPGEF4POLBGAASMN1; SMN2
SCHEMBL17203486 0.82 POLB (0.40) TRPV4L3MBTL1POLBSMN1; SMN2
SCHEMBL17203518 0.82 POLB (0.37) TRPV4L3MBTL1POLBSMN1; SMN2
SCHEMBL26512771 0.82 CA1 (0.31) TRPV4
SCHEMBL1169702 0.79 CA12 (0.38) TRPV4L3MBTL1
SCHEMBL19613829 0.78 POLB (0.37) TRPV4L3MBTL1POLBSMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0202493-B1 PROCESS FOR THE PREPARATION OF 5-FLUOROTOLUENE-2,4-DISULFOCHLORIDE BAYER AG (DE) 1988-08-24 EP claimed
US-4740333-A Process for the preparation of 5-fluorotoluene-2,4-disulphochloride BAYER AKTIENGESELLSCHAFT (DE) 1988-04-26 US claimed
US-5723613-A Process for the free-radical chlorination or bromination of methyl aromatic compounds BAYER AKTIENGESELLSCHAFT (DE) 1998-03-03 US disclosed
US-4740333-A Process for the preparation of 5-fluorotoluene-2,4-disulphochloride BAYER AKTIENGESELLSCHAFT (DE) 1988-04-26 US disclosed
US-4740333-A Process for the preparation of 5-fluorotoluene-2,4-disulphochloride BAYER AKTIENGESELLSCHAFT (DE) 1988-04-26 US disclosed
US-4740333-A Process for the preparation of 5-fluorotoluene-2,4-disulphochloride BAYER AKTIENGESELLSCHAFT (DE) 1988-04-26 US disclosed
EP-0202493-A1 Process for the preparation of 5-fluorotoluene-2,4-disulfochloride BAYER AG (DE) 1986-11-26 EP disclosed