SCHEMBL5226953

SCHEMBL5226953

O=S(=O)(NCc1ccc(C(F)(F)F)cc1)c1cc(Br)c(Cl)s1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP19A1 P11511 1/20 0.48
NSD2 O96028 2/20 0.44
RAD51 Q06609 1/20 0.44
GALR3 O60755 1/20 0.44
LMNA P02545 1/20 0.44
HTT P42858 1/20 0.44
RAB9A P51151 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
SCN3A Q9NY46 1/20 0.44
MAPT P10636 2/20 0.42
MEN1 O00255 1/20 0.42
KMT2A Q03164 1/20 0.42
CNR1 P21554 1/20 0.42
ALDH1A1 P00352 1/20 0.41
NAMPT P43490 1/20 0.40
POLB P06746 2/20 0.39
CA2 P00918 2/20 0.39
CA12 O43570 1/20 0.39
CA1 P00915 1/20 0.39
CA9 Q16790 1/20 0.39

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
SCHEMBL5227872 0.82 CYP19A1 (0.46) CYP19A1NSD2LMNASMN1; SMN2SCN3A
SCHEMBL5229776 0.82 MEN1 (0.55) MAPTMEN1KMT2ACA2CA1
SCHEMBL8870068 0.77 CA2 (0.56) CYP19A1NSD2GALR3LMNAHTT
SCHEMBL5229967 0.75 P2RX1 (0.47) RAD51LMNAHTTSMN1; SMN2MAPT
SCHEMBL5226626 0.71 CYP19A1 (0.57) CYP19A1NSD2LMNARAB9ASCN3A
SCHEMBL27614745 0.70 MAOB (0.40) LMNAHTTRAB9AMAPTPOLB
SCHEMBL3853891 0.69 CYP19A1 (0.70) CYP19A1NSD2LMNARAB9ASMN1; SMN2
SCHEMBL9218252 0.68 NSD2 (0.52) CYP19A1NSD2SCN3AMAPTMEN1
SCHEMBL1510259 0.68 FBP1 (0.48) RAD51LMNARAB9ASMN1; SMN2MAPT
SCHEMBL30435065 0.68 KMT2A (0.54) CYP19A1NSD2SCN3AKMT2ACNR1

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
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 CYP19A1 2615/4885NSD2 709/4885RAD51 2279/4885

“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.