SCHEMBL5514742

SCHEMBL5514742

O=C1Nc2ccc(Br)cc2C(C(F)(F)F)(C(F)(F)F)O1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.41
LMNA P02545 2/20 0.41
MEN1 O00255 2/20 0.41
KMT2A Q03164 2/20 0.41
GAA P10253 2/20 0.41
ALPL P05186 1/20 0.41
HSP90AA1 P07900 1/20 0.41
ALPI P09923 1/20 0.41
ALPG P10696 1/20 0.41
TLR9 Q9NR96 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
PGR P06401 4/20 0.39
CYP46A1 Q9Y6A2 2/20 0.39
NR3C1 P04150 2/20 0.39
NR1I2 O75469 1/20 0.39
ADRB1 P08588 1/20 0.39
ADORA3 P0DMS8 1/20 0.39
CNR1 P21554 1/20 0.39
SLC6A2 P23975 1/20 0.39
HTR2A P28223 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
SCHEMBL5517235 0.77 ELOVL6 (0.46) MAPTLMNAMEN1KMT2AGAA
Brofoxine SCHEMBL61925 0.76 PGR (0.59) PGRNR3C1NR3C2AR
Brofoxine SCHEMBL29710912 0.76 PGR (0.59) PGRNR3C1NR3C2AR
SCHEMBL4120633 0.72 ELOVL6 (0.42) MAPTLMNAMEN1KMT2AGAA
SCHEMBL5518253 0.72 LMNA (0.44) MAPTLMNAMEN1KMT2AGAA
SCHEMBL4162748 0.72 LMNA (0.44) MAPTLMNAMEN1KMT2AGAA
SCHEMBL3883846 0.71 POLB (0.43) MAPTLMNAMEN1KMT2AGAA
SCHEMBL5516094 0.71 LMNA (0.42) MAPTLMNAMEN1KMT2AGAA
SCHEMBL30847598 0.70 LMNA (0.47) MAPTLMNAMEN1KMT2AGAA
Brofoxine SCHEMBL4166335 0.69 PGR (0.68) PGRNR3C1NR3C2AR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7268149-B2 Cyclothiocarbamate derivatives as progesterone receptor modulators and methods of treating skin disorders WYETH (US) 2007-09-11 US disclosed
US-7192956-B2 Methods of treating hormone-related conditions using cyclothiocarbamate derivatives WYETH (US) 2007-03-20 US disclosed
EP-1515725-A4 USE OF CYCLOTHIOCARBAMATE DERIVATIVES IN TREATMENT OF HORMONE-RELATED CONDITIONS WYETH CORP (US) 2005-09-21 EP disclosed
EP-1531824-A4 CYCLOTHIOCARBAMATIVE DERIVATIVES AS PR MODULATORS AND USE THEREOF FOR TREATMENT OF SKIN DISORDERS WYETH CORP (US) 2005-09-21 EP disclosed
EP-1531824-A2 CYCLOTHIOCARBAMATIVE DERIVATIVES AS PR MODULATORS AND USE THEREOF FOR TREATMENT OF SKIN DISORDERS Wyeth (US) 2005-05-25 EP disclosed
EP-1515725-A2 USE OF CYCLOTHIOCARBAMATE DERIVATIVES IN TREATMENT OF HORMONE-RELATED CONDITIONS Wyeth (US) 2005-03-23 EP disclosed
US-20040014798-A1 Cyclothiocarbamate derivatives as progesterone receptor modulators and methods of treating skin disorders WYETH 2004-01-22 US disclosed
US-20040006060-A1 Methods of treating hormone-related conditions using cyclothiocarbamate derivatives WYETH 2004-01-08 US disclosed
WO-2004000801-A2 USE OF CYCLOTHIOCARBAMATE DERIVATIVES IN TREATMENT OF HORMONE-RELATED CONDITIONS WYETH (US) 2003-12-31 WO disclosed
WO-2004000230-A2 CYCLOTHIOCARBAMATIVE DERIVATIVES AS PR MODULATORS AND USE THEREOF FOR TREATMENT OF SKIN DISORDERS WYETH (US) 2003-12-31 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 (2 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-20040006060-A1 Methods of treating hormone-related conditions using cyclothiocarbamate derivatives ESRRA, GNRHR, ESRRG MAPT 1080/4885LMNA 844/4885MEN1 402/4885
US-20040014798-A1 Cyclothiocarbamate derivatives as progesterone receptor modulators and methods of treating skin disorders NR5A1, MC1R, CYP17A1 MAPT 821/4885LMNA 4684/4885MEN1 3679/4885

“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.