SCHEMBL8387010

SCHEMBL8387010

[O]S(=O)(=O)c1[c]cccc1

nearest known ligand 0.31

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
HTR6 P50406 1/20 0.31
FAAH O00519 1/20 0.30
PRSS1 P07477 1/20 0.30
PRSS2 P07478 1/20 0.30
ELANE P08246 1/20 0.30
PRTN3 P24158 1/20 0.30
PRSS3 P35030 1/20 0.30
CA1 P00915 1/20 0.30
CA2 P00918 1/20 0.30
CA5A P35218 1/20 0.30
CA9 Q16790 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
SCHEMBL150811 0.82 HTR6 (0.38) HTR6FAAHPRSS1PRSS2ELANE
SCHEMBL6135776 0.78
SCHEMBL77668 0.78 PTGS2 (0.33)
SCHEMBL219484 0.78 TSHR (0.42) CA1CA2
SCHEMBL1727931 0.78 ELANE (0.38) FAAHPRSS1PRSS2ELANEPRTN3
SCHEMBL1726647 0.78
SCHEMBL76930 0.78 CA2 (0.42) CA1CA2CA5ACA9
SCHEMBL600073 0.78 ALDH1A1 (0.42)
SCHEMBL1727551 0.78
SCHEMBL6409394 0.76 PTPN1 (0.34) CA2CA9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0597411-B1 Process for the preparation of phthalocyanine reactive dyes BASF AG (DE) 1999-04-28 EP disclosed
US-5629409-A Reactive disazo dyes having two cyanuric chloride mechanisms BASF AKTIENGESELLSCHAFT (DE) 1997-05-13 US disclosed
US-5516901-A Preparation of reactive phthalocyanine dyes BASF AKTIENGESELLSCHAFT (DE) 1996-05-14 US disclosed
CN-1113508-A Reactive disazo dyes having two cyanuric chloride mechanisms BASF AG (DE) 1995-12-20 CN disclosed
EP-0671442-A2 Disazo reactive dyes having two anchors based on cyanuric chloride BASF AKTIENGESELLSCHAFT (DE) 1995-09-13 EP disclosed
US-5444163-A Preparation of reactive phthalocyanine dyes BASF AKTIENGESELLSCHAFT (DE) 1995-08-22 US disclosed
EP-0602562-A1 Process for the preparation of phthalocyanine reactive dyes BASF Aktiengesellschaft (DE) 1994-06-22 EP disclosed
EP-0597411-A1 Process for the preparation of phthalocyanine reactive dyes BASF Aktiengesellschaft (DE) 1994-05-18 EP disclosed