SCHEMBL191774

SCHEMBL191774

C[C@]12CCCCC1CC[C@@H]1[C@@H]2CC[C@]2(C)C(C(=S)OCF)CC[C@@H]12

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.46
AKR1B10 O60218 2/20 0.46
AKR1B1 P15121 2/20 0.46
MEN1 O00255 2/20 0.46
LMNA P02545 2/20 0.46
EFNA1 P20827 1/20 0.46
EPHA2 P29317 1/20 0.46
PSEN1 P49768 1/20 0.46
PSEN2 P49810 1/20 0.46
GPBAR1 Q8TDU6 1/20 0.46
APH1B Q8WW43 1/20 0.46
NCSTN Q92542 1/20 0.46
APH1A Q96BI3 1/20 0.46
PSENEN Q9NZ42 1/20 0.46
HSD17B10 Q99714 1/20 0.46
TDP1 Q9NUW8 1/20 0.46
G6PD P11413 5/20 0.44
CYP19A1 P11511 1/20 0.43
CYP3A4 P08684 2/20 0.42
PMP22 Q01453 2/20 0.42

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
SCHEMBL6236389 1.00 KMT2A (0.46) KMT2AAKR1B10AKR1B1MEN1LMNA
SCHEMBL5481340 0.81 MEN1 (0.52) KMT2AAKR1B10AKR1B1MEN1LMNA
SCHEMBL5481343 0.81 MEN1 (0.52) KMT2AAKR1B10AKR1B1MEN1LMNA
SCHEMBL3988188 0.79 G6PD (0.58) KMT2AAKR1B10AKR1B1MEN1LMNA
SCHEMBL3988193 0.79 G6PD (0.58) KMT2AAKR1B10AKR1B1MEN1LMNA
SCHEMBL27718581 0.77 MEN1 (0.53) KMT2AAKR1B10AKR1B1MEN1LMNA
SCHEMBL11350178 0.77 G6PD (0.72) KMT2AAKR1B10AKR1B1MEN1LMNA
SCHEMBL11226874 0.76 MEN1 (0.48) KMT2AAKR1B10AKR1B1MEN1LMNA
SCHEMBL11226868 0.76 MEN1 (0.48) KMT2AAKR1B10AKR1B1MEN1LMNA
SCHEMBL23872369 0.76 GABRA1 (0.69) KMT2AAKR1B10AKR1B1MEN1LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2402361-B1 PROCESS FOR THE PREPARATION OF S-FLUOROMETHYL-6,9-DIFLUORO-11-HYDROXY-16-METHYL-17-PROPIONYLOXY-3-OXO-ANDROSTA-1,4-DIENE-17-CARBOTHIOATE AND INTERMEDIATES GENERICS UK LTD (GB) 2020-04-15 EP disclosed
EP-2402360-B1 Process for the preparation of S-fluoromethyl-6,9-difluoro-11-hydroxy-16-methyl-17-propionyloxy-3-oxo-androsta-1,4-diene-17-carbothioate and intermediates GENERICS UK LTD (GB) 2020-04-01 EP disclosed
WO-2015199626-A1 STABLE AEROSOL FORMULATIONS OF β2- ADRENERGIC AGONISTS WORLD MEDICINE İLAÇ SANAYİ VE TİCARET ANONİM ŞİRKETİ (TR) 2015-12-30 WO disclosed
US-8841442-B2 Process for preparing fluticasone propionate/furoate CADILA HEALTHCARE LIMITED (IN) 2014-09-23 US disclosed
US-20140148593-A1 PROCESS FOR PREPARING FLUTICASONE PROPIONATE/FUROATE CADILA HEALTHCARE LIMITED (IN) 2014-05-29 US disclosed
US-20130172587-A1 Process for the Preparation of Fluticasone Propionate GENERICS [UK] LIMITED (GB) 2013-07-04 US disclosed
US-8344168-B2 Process for the preparation of fluticasone propionate GENERICS (UK) LIMITED (GB) 2013-01-01 US disclosed
EP-2044099-B1 PROCESS FOR THE PREPARATION OF S-FLUOROMETHYL-6 ,9 -DIFLUORO-11 -HYDROXY-16 -METHYL-17 -PROPIONYLOXY-3-OXO-ANDROSTA-1,4-DIENE-17 -CARBOTHIOATE AND INTERMEDIATES GENERICS UK LTD (GB) 2012-05-23 EP disclosed
EP-2402360-A1 Process for the preparation of S-fluoromethyl-6,9-difluoro-11-hydroxy-16-methyl-17-propionyloxy-3-oxo-androsta-1,4-diene-17-carbothioate and intermediates Generics (UK) Limited (GB) 2012-01-04 EP disclosed
EP-2402361-A1 Process for the preparation of S-fluoromethyl-6,9-difluoro-11-hydroxy-16-methyl-17-propionyloxy-3-oxo-androsta-1,4-diene-17-carbothioate and intermediates Generics (UK) Limited (GB) 2012-01-04 EP disclosed
US-20090177001-A1 NOVEL PROCESS AND INTERMEDIATES GENERICS [UK] LIMITED (INCORPORATED IN THE UNITED KINGDOM] (GB) 2009-07-09 US disclosed
EP-2044099-A2 PROCESS FOR THE PREPARATION OF S-FLUOROMETHYL-6 ,9 -DIFLUORO-11 -HYDROXY-16 -METHYL-17 -PROPIONYLOXY-3-OXO-ANDROSTA-1,4-DIENE-17 -CARBOTHIOATE AND INTERMEDIATES Merck Generics (UK) Limited (GB) 2009-04-08 EP disclosed
WO-2007144668-A2 PROCESS FOR THE PREPARATION OF S-FLUOROMETHYL-6, 9 -DIFLUORO-11 -HYDROXY-16 -METHYL-17-PROPIONYLOXY-3-OXO-ANDROSTA-1,4-DIENE-17 -CARBOTHIOATE AND INTERMEDIATES GENERICS [UK] LIMITED (GB) 2007-12-21 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 (3 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-20130172587-A1 Process for the Preparation of Fluticasone Propionate CYP17A1, NR5A1, CYP4F3 KMT2A 3275/4885AKR1B10 513/4885AKR1B1 206/4885
US-20090177001-A1 NOVEL PROCESS AND INTERMEDIATES CYP17A1, NR5A1, CYP21A2 KMT2A 3636/4885AKR1B10 399/4885AKR1B1 193/4885
US-20140148593-A1 PROCESS FOR PREPARING FLUTICASONE PROPIONATE/FUROATE CYP4F3, CYP3A5, CYP51A1 KMT2A 3457/4885AKR1B10 747/4885AKR1B1 448/4885

“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.