SCHEMBL7572845

SCHEMBL7572845

O=S(=O)(Nc1ccccc1)c1ccc(C(F)(F)F)cc1

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.67
PKM P14618 2/20 0.67
MEN1 O00255 2/20 0.67
ALDH1A1 P00352 1/20 0.67
AR P10275 1/20 0.66
ERAP1 Q9NZ08 2/20 0.66
IL1RN P18510 1/20 0.66
KEAP1 Q14145 1/20 0.66
NR1H3 Q13133 1/20 0.62
CA12 O43570 1/20 0.61
CA1 P00915 1/20 0.61
CA2 P00918 1/20 0.61
CA9 Q16790 1/20 0.61
GPR27 Q9NS67 4/20 0.60
AVPR2 P30518 3/20 0.60
PTGES2 Q9H7Z7 1/20 0.59
FFAR1 O14842 1/20 0.59
CDK1 P06493 1/20 0.59
CCNB1 P14635 1/20 0.59
CCNA2 P20248 1/20 0.59

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
SCHEMBL2567685 0.93 NR1H3 (0.71) KMT2APKMMEN1ALDH1A1AR
SCHEMBL14601685 0.91 MEN1 (0.65) KMT2AMEN1ALDH1A1ARNR1H3
SCHEMBL12010881 0.88 MEN1 (0.68) KMT2AMEN1ALDH1A1ARNR1H3
SCHEMBL12947549 0.85 KMT2A (0.61) KMT2APKMMEN1ALDH1A1AR
SCHEMBL7577535 0.84 CA1 (0.65) KMT2APKMMEN1ALDH1A1AR
SCHEMBL7588697 0.84 PTGES2 (0.74) KMT2AMEN1CA1CA2PTGES2
SCHEMBL12010912 0.83 NR1H3 (0.68) KMT2AMEN1ALDH1A1ARNR1H3
SCHEMBL18031173 0.83 UQCRB (0.71) KMT2AMEN1ARERAP1NR1H3
SCHEMBL7571036 0.83 CES1 (0.73) KMT2AMEN1ALDH1A1ARCA1
SCHEMBL4573249 0.83 KMT2A (0.71) KMT2AMEN1ALDH1A1ARKEAP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-108822002-B Method for synthesizing N-aryl sulfonamide under assistance of ultrasonic waves 中南大学 2020-05-05 CN disclosed
CN-108822002-A A kind of method of ultrasonic wave added synthesis N- aryl sulfonic acid amides 中南大学 2018-11-16 CN disclosed
EP-1239852-A2 BISSULFONAMIDE DERIVATIVES AS ENZYME INHIBITORS Arrow Therapeutics Limited (GB) 2002-09-18 EP disclosed
WO-2001028537-A2 BISSULFONAMIDE DERIVATIVES AS ENZYME INHIBITORS ARROW THERAPEUTICS LIMITED (GB) 2001-04-26 WO disclosed