SCHEMBL5332920

SCHEMBL5332920

N#Cc1cccc(S(=O)(=O)NCCCBr)c1

nearest known ligand 0.53

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
PGR P06401 1/20 0.46
CYP19A1 P11511 1/20 0.46
KMT2A Q03164 2/20 0.45
ALDH1A1 P00352 2/20 0.45
KDM4E B2RXH2 1/20 0.45
LMNA P02545 1/20 0.45
PKM P14618 1/20 0.45
SMN1; SMN2 Q16637 1/20 0.45
KAT6A Q92794 1/20 0.44
GLO1 Q04760 1/20 0.44
SLC40A1 Q9NP59 1/20 0.44
ACLY P53396 2/20 0.43
RXFP1 Q9HBX9 1/20 0.43
SCN9A Q15858 1/20 0.42
ATM Q13315 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.41
MEN1 O00255 1/20 0.41
TRIM24 O15164 1/20 0.41
MAPT P10636 1/20 0.41

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
SCHEMBL18881484 0.83 LMNA (0.53) PGRCYP19A1KMT2AALDH1A1KDM4E
SCHEMBL12953965 0.82 KMT2A (0.51) PGRCYP19A1KMT2AALDH1A1LMNA
SCHEMBL12481561 0.82 CYP2C19 (0.58) PGRCYP19A1KMT2AALDH1A1KDM4E
SCHEMBL3120110 0.82 CYP19A1 (0.59) CYP19A1KMT2AALDH1A1KDM4ELMNA
SCHEMBL3861545 0.82 ALDH1A1 (0.51) CYP19A1ALDH1A1ATML3MBTL1
SCHEMBL13894238 0.82 TSHR (0.51) PGRCYP19A1KMT2AALDH1A1KAT6A
SCHEMBL3856855 0.80 ALDH1A1 (0.49) CYP19A1KMT2AALDH1A1KAT6A
SCHEMBL4615617 0.79 PGR (0.50) PGRCYP19A1KMT2AALDH1A1KDM4E
SCHEMBL3861652 0.79 LSS (0.50) CYP19A1KMT2AALDH1A1
SCHEMBL1246685 0.78 SCN9A (0.52) PGRCYP19A1KMT2AALDH1A1LMNA

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
US-7288537-B2 Azetidine derivatives as CCR-3 receptor antagonists NOVARTIS AG (CH) 2007-10-30 US disclosed
US-20050222118-A1 Azetidine derivatives as ccr-3 receptor antagonists NOVARTIS AG (CH) 2005-10-06 US disclosed
EP-1487435-A1 AZETIDINE DERIVATIVES AS CCR-3 RECEPTOR ANTAGONISTS Novartis AG (CH) 2004-12-22 EP disclosed
WO-2003077907-A1 AZETIDINE DERIVATIVES AS CCR-3 RECEPTOR ANTAGONISTS NOVARTIS AG (CH) 2003-09-25 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-20050222118-A1 Azetidine derivatives as ccr-3 receptor antagonists CCR3, CCR1, CCR9 PGR 416/4885CYP19A1 3656/4885KMT2A 3058/4885

“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.