SCHEMBL9616562

SCHEMBL9616562

Nc1cccc(NS(=O)(=O)c2ccc3ccccc3c2)c1

nearest known ligand 0.72

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 4/20 0.72
MEN1 O00255 3/20 0.72
HTR6 P50406 3/20 0.69
POLB P06746 1/20 0.65
SMN1; SMN2 Q16637 4/20 0.62
LMNA P02545 2/20 0.62
PKM P14618 1/20 0.61
PKLR P30613 1/20 0.61
ATM Q13315 1/20 0.60
HTR1A P08908 1/20 0.60
HTR2A P28223 1/20 0.60
HTR2C P28335 1/20 0.60
HTR7 P34969 1/20 0.60
DRD3 P35462 1/20 0.60
PGR P06401 1/20 0.57
AKR1C3 P42330 1/20 0.57
KAT6A Q92794 1/20 0.56
GHSR Q92847 1/20 0.56
PLAU P00749 2/20 0.56
PFKFB3 Q16875 1/20 0.55

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
SCHEMBL9465080 0.84 KMT2A (0.70) KMT2AMEN1HTR6POLBSMN1; SMN2
SCHEMBL28396503 0.84 PGR (0.77) KMT2AMEN1SMN1; SMN2LMNAPKM
SCHEMBL20021987 0.84 PGR (0.77) KMT2AMEN1SMN1; SMN2LMNAPKM
SCHEMBL29549847 0.84 PGR (0.77) KMT2AMEN1SMN1; SMN2LMNAPKM
SCHEMBL28271796 0.84 HTR6 (0.83) KMT2AHTR6POLBSMN1; SMN2LMNA
SCHEMBL28271812 0.82 HTR6 (1.00) KMT2AHTR6POLBPKMHTT
SCHEMBL2723618 0.82 HTR6 (1.00) KMT2AMEN1HTR6POLBSMN1; SMN2
SCHEMBL3258120 0.82 KMT2A (0.68) KMT2AMEN1HTR6SMN1; SMN2LMNA
SCHEMBL28511975 0.81 HTR6 (0.73) KMT2AMEN1HTR6POLBPKM
Hydrochloric Acid SCHEMBL18953392 0.81 HTR6 (0.97) KMT2AMEN1HTR6POLBSMN1; SMN2

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
EP-0462179-A4 NOVEL SULFONAMIDES AS RADIOSENSITIZERS 1992-03-18 EP claimed
EP-0462179-A1 NOVEL SULFONAMIDES AS RADIOSENSITIZERS THE DU PONT MERCK PHARMACEUTICAL COMPANY (US) 1991-12-27 EP claimed
WO-1990009787-A1 NOVEL SULFONAMIDES AS RADIOSENSITIZERS THE DU PONT MERCK PHARMACEUTICAL COMPANY (US) 1990-09-07 WO claimed