SCHEMBL5700365

SCHEMBL5700365

Cc1ccc(S(=O)(=O)c2cc(Br)ccn2)cc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ GAA P10253 1/20 0.48
▸ HSP90AA1 P07900 2/20 0.46
▸ COMT P21964 4/20 0.46
▸ KMT2A Q03164 3/20 0.44
▸ CXCR5 P32302 1/20 0.44
▸ APLNR P35414 1/20 0.44
▸ RAB9A P51151 1/20 0.44
▸ CCR6 P51684 1/20 0.44
▸ GFER P55789 1/20 0.44
▸ AKR1B1 P15121 1/20 0.44
▸ RAPGEF4 Q8WZA2 1/20 0.43
▸ LMNA P02545 3/20 0.43
▸ PKM P14618 2/20 0.43
▸ MEN1 O00255 1/20 0.43
▸ NPSR1 Q6W5P4 1/20 0.43
▸ MAPT P10636 3/20 0.40
▸ SMN1; SMN2 Q16637 2/20 0.40
▸ TDP1 Q9NUW8 2/20 0.40
▸ TP53 P04637 1/20 0.40
▸ PAX8 Q06710 1/20 0.40

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
SCHEMBL5700502 0.80 KDM4E (0.50) GAAHSP90AA1COMTKMT2ACXCR5
SCHEMBL5700395 0.80 GAA (0.48) GAAHSP90AA1COMTKMT2ACXCR5
SCHEMBL7459868 0.74 KDM4E (0.69) GAAHSP90AA1COMTKMT2ACXCR5
SCHEMBL31225276 0.73 CYP2C19 (0.46) GAACOMTKMT2ALMNAMEN1
SCHEMBL13633501 0.73 KDM4E (0.58) KMT2ALMNAMAPTSMN1; SMN2KDM4E
SCHEMBL10661374 0.73 KMT2A (0.47) GAAHSP90AA1COMTKMT2ACXCR5
SCHEMBL1573581 0.72 ALDH1A1 (0.52) KMT2AAKR1B1LMNAPKMNPSR1
SCHEMBL7566063 0.72 GAA (0.52) GAAHSP90AA1KMT2ACXCR5APLNR
SCHEMBL27144916 0.72 GAA (0.40) GAAHSP90AA1COMTKMT2ACXCR5
SCHEMBL4616138 0.72 GAA (0.76) GAAKMT2ARAPGEF4LMNAPKM

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1270582-B1 TRIPHENYLPHOSPHINE DERIVATIVES, PALLADIUM OR NICKEL COMPLEXES THEREOF, AND PROCESS FOR PREPARING BIARYL DERIVATIVES MITSUBISHI RAYON CO (JP) 2006-08-30 — — EP disclosed
EP-1270582-A1 TRIPHENYLPHOSPHINE DERIVATIVE, PRODUCTION PROCESS THEREFOR, PALLADIUM COMPLEX THEREOF, AND PROCESS FOR PRODUCING BIARYL DERIVATIVE Mitsubishi Rayon Co., Ltd. (JP) 2003-01-02 — — EP disclosed
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