SCHEMBL5226880

SCHEMBL5226880

O=C(O)c1cccc(S(=O)(=O)Nc2cc(C(F)(F)F)cc(C(F)(F)F)c2)c1

nearest known ligand 0.62

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
GAA P10253 2/20 0.62
AKR1C3 P42330 2/20 0.60
AKR1C2 P52895 1/20 0.60
ALDH1A1 P00352 1/20 0.57
PPARG P37231 1/20 0.56
PFKFB3 Q16875 1/20 0.56
ERAP1 Q9NZ08 1/20 0.56
MEN1 O00255 4/20 0.56
KMT2A Q03164 4/20 0.56
THRB P10828 1/20 0.55
MAPT P10636 2/20 0.54
POLB P06746 2/20 0.54
USP2 O75604 1/20 0.54
HSD17B10 Q99714 1/20 0.54
KDM4E B2RXH2 1/20 0.53
TSHR P16473 1/20 0.53
PTK2B Q14289 1/20 0.53
GFER P55789 1/20 0.53
CASP6 P55212 1/20 0.53

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
SCHEMBL396095 0.89 AKR1C3 (0.62) GAAAKR1C3ALDH1A1PFKFB3ERAP1
SCHEMBL14153140 0.86 PFKFB3 (0.67) GAAAKR1C3ALDH1A1PFKFB3ERAP1
SCHEMBL12789658 0.85 PPARG (0.64) GAAALDH1A1PPARGERAP1MEN1
SCHEMBL22633492 0.85 GAA (0.68) GAAAKR1C3ALDH1A1PFKFB3MEN1
SCHEMBL14149924 0.83 PFKFB3 (0.62) GAAAKR1C3ALDH1A1PFKFB3ERAP1
SCHEMBL30702319 0.81 PFKFB3 (0.76) AKR1C3PFKFB3MEN1KMT2ATHRB
SCHEMBL4063367 0.81 PFKFB3 (0.76) AKR1C3PFKFB3MEN1KMT2ATHRB
SCHEMBL30702318 0.81 PFKFB3 (0.76) AKR1C3PFKFB3MEN1KMT2ATHRB
SCHEMBL14106176 0.81 GAA (0.62) GAAAKR1C3ALDH1A1PFKFB3ERAP1
SCHEMBL14106182 0.80 PTPN1 (0.57) GAAAKR1C3ALDH1A1ERAP1MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1519932-B1 BISARYLSULFONAMIDE COMPOUNDS AND THEIR USE IN CANCER THERAPY CYCLACEL LTD (GB) 2007-10-03 EP claimed
US-20050215548-A1 Capable of binding to the oncoprotein HDM2 and modulating the HDM2-dependent regulation of the tumour suppressor p53 and/or E2F transcription factors; e.g. 5-Chloro-4-nitro-thiophene-2-sulfonic acid (4-nitrophenyl)-amide CYCLACEL LIMITED (GB) 2005-09-29 US claimed
EP-1519932-A1 BISARYLSULFONAMIDE COMPOUNDS AND THEIR USE IN CANCER THERAPY Cyclacel Limited (GB) 2005-04-06 EP claimed
WO-2004005278-A1 BISARYLSULFONAMIDE COMPOUNDS AND THEIR USE IN CANCER THERAPY CYCLACEL LIMITED (GB) 2004-01-15 WO claimed
EP-1519932-B1 BISARYLSULFONAMIDE COMPOUNDS AND THEIR USE IN CANCER THERAPY CYCLACEL LTD (GB) 2007-10-03 EP disclosed
US-20050215548-A1 Capable of binding to the oncoprotein HDM2 and modulating the HDM2-dependent regulation of the tumour suppressor p53 and/or E2F transcription factors; e.g. 5-Chloro-4-nitro-thiophene-2-sulfonic acid (4-nitrophenyl)-amide CYCLACEL LIMITED (GB) 2005-09-29 US disclosed
EP-1519932-A1 BISARYLSULFONAMIDE COMPOUNDS AND THEIR USE IN CANCER THERAPY Cyclacel Limited (GB) 2005-04-06 EP disclosed
WO-2004005278-A1 BISARYLSULFONAMIDE COMPOUNDS AND THEIR USE IN CANCER THERAPY CYCLACEL LIMITED (GB) 2004-01-15 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20050215548-A1 Capable of binding to the oncoprotein HDM2 and modulating the HDM2-dependent regulation of the tumour suppressor p53 and/or E2F transcription factors; e.g. 5-Chloro-4-nitro-thiophene-2-sulfonic acid (4-nitrophenyl)-amide CCNL2, TP53, MDM2 GAA 4172/4885AKR1C3 2116/4885AKR1C2 2177/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.