SCHEMBL10389367

SCHEMBL10389367

Nc1cc(Cl)ccc1S(=O)(=O)c1ccc2ccccc2c1S(=O)(=O)O

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ HSP90AA1 P07900 2/20 0.40
▸ HSP90AB1 P08238 2/20 0.40
▸ CYP2D6 P10635 1/20 0.38
▸ SENP2 Q9HC62 2/20 0.37
▸ SENP1 Q9P0U3 2/20 0.37
▸ SUMO2 P61956 1/20 0.37
▸ SUMO1 P63165 1/20 0.37
▸ SENP7 Q9BQF6 1/20 0.37
▸ SENP3 Q9H4L4 1/20 0.37
▸ GAA P10253 1/20 0.37
▸ LMNA P02545 1/20 0.36
▸ MAPT P10636 1/20 0.36
▸ HTT P42858 1/20 0.36
▸ CTRB1 P17538 1/20 0.36
▸ CYP2C9 P11712 1/20 0.36
▸ MPL P40238 1/20 0.35
▸ CTRC Q99895 1/20 0.35
▸ TTR P02766 1/20 0.35
▸ HTR6 P50406 1/20 0.35
▸ CYP2A6 P11509 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
SCHEMBL10390196 0.91 HSP90AA1 (0.43) HSP90AA1HSP90AB1CYP2D6SENP2SENP1
SCHEMBL10389341 0.84 SLC40A1 (0.39) CYP2D6SENP2SENP1SUMO2SUMO1
SCHEMBL10389371 0.83 LMNA (0.45) CYP2D6GAALMNAMAPTCYP2C9
SCHEMBL41541 0.76 CYP2D6 (0.53) CYP2D6SENP2SENP1SUMO2SUMO1
SCHEMBL10661698 0.76 CYP3A4 (0.52) CYP2D6GAAMAPTCYP2C9MEN1
SCHEMBL9818528 0.76 HSP90AA1 (0.46) HSP90AA1HSP90AB1GAALMNAMAPT
SCHEMBL10390245 0.75 HTR6 (0.63) CYP2D6LMNACTRB1CYP2C9HTR6
SCHEMBL4897459 0.75 CYP2D6 (0.51) CYP2D6GAAMAPTCTRB1CYP2C9
Hydrochloric Acid SCHEMBL251599 0.75 CTRB1 (0.55) CYP2D6CTRB1CYP2C9MPLCTRC
SCHEMBL2242476 0.75 CYP2D6 (0.51) CYP2D6SENP2SENP1SUMO2SUMO1

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-4918183-A Monoazo dyes, process for their preparation, and the use thereof CIBA-GEIGY CORPORATION (US) 1990-04-17 — — US disclosed
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