SCHEMBL6111641

SCHEMBL6111641

Cc1ccc(S(=O)(=O)Oc2cccc3cc(N)ccc23)cc1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 4/20 0.56
▸ KMT2A Q03164 4/20 0.56
▸ ESR1 P03372 1/20 0.56
▸ GAA P10253 1/20 0.56
▸ ESR2 Q92731 1/20 0.56
▸ CYP1A2 P05177 1/20 0.47
▸ LMNA P02545 2/20 0.44
▸ MAPK1 P28482 1/20 0.44
▸ ALDH1A1 P00352 2/20 0.43
▸ MAPT P10636 2/20 0.43
▸ HTR6 P50406 1/20 0.43
▸ KDM4E B2RXH2 1/20 0.41
▸ HPGD P15428 1/20 0.41
▸ KEAP1 Q14145 1/20 0.41
▸ NFE2L2 Q16236 1/20 0.41
▸ HTT P42858 1/20 0.40
▸ CYP2C19 P33261 1/20 0.40
▸ TUBB4A P04350 1/20 0.40
▸ TUBB P07437 1/20 0.40
▸ TUBA3C P0DPH7 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
SCHEMBL1073454 0.83 MEN1 (0.68) MEN1KMT2AESR1GAAESR2
SCHEMBL5366484 0.80 MEN1 (0.56) MEN1KMT2AESR1GAAESR2
SCHEMBL28390792 0.80 HTR6 (0.55) MEN1KMT2AESR1GAAESR2
SCHEMBL15442508 0.78 KMT2A (0.60) MEN1KMT2AESR1GAAESR2
SCHEMBL10712681 0.77 PLAU (0.50) GAALMNAALDH1A1MAPTHTR6
SCHEMBL9131043 0.76 LMNA (0.56) MEN1KMT2AESR1GAAESR2
SCHEMBL31572327 0.76 LMNA (0.56) MEN1KMT2AESR1GAAESR2
SCHEMBL64533 0.76 KMT2A (0.62) MEN1KMT2AESR1GAAESR2
SCHEMBL14875638 0.76 KMT2A (0.56) MEN1KMT2AESR1GAAESR2
SCHEMBL13995003 0.75 CYP1A2 (0.66) MEN1KMT2AESR1GAAESR2

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
US-7247756-B2 1,4-disubstituted benzenes as insecticides BAYER CROPSCIENCE AG (DE) 2007-07-24 — — US disclosed
US-7247756-B2 1,4-disubstituted benzenes as insecticides BAYER CROPSCIENCE AG (DE) 2007-07-24 — — US disclosed
WO-2006078619-A1 INSECTICIDAL HETEROCYCLIC 1,4-DISUBSTITUTED BENZENE N-OXIDES BAYER CROPSCIENCE AG (DE) 2006-07-27 — — WO disclosed
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