SCHEMBL4169534

SCHEMBL4169534

Oc1ccc(F)c(C=C2c3ccccc3CCc3ccccc32)c1

nearest known ligand 0.42

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
MIF P14174 7/20 0.42
MAOB P27338 2/20 0.40
TYR P14679 2/20 0.39
CYP26A1 O43174 2/20 0.39
NR3C2 P08235 3/20 0.37
SIRT1 Q96EB6 1/20 0.37
PBRM1 Q86U86 1/20 0.37
NR3C1 P04150 1/20 0.36
PGR P06401 1/20 0.36
AR P10275 1/20 0.36

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
SCHEMBL4174201 0.78 MAPT (0.46) MIFMAOBCYP26A1AR
SCHEMBL4165860 0.76 LCK (0.45) MIFMAOBNR3C2SIRT1NR3C1
SCHEMBL4165178 0.74 MIF (0.49) MIFNR3C2NR3C1PGRAR
SCHEMBL4170410 0.74 MIF (0.56) MIFMAOBCYP26A1
SCHEMBL4170407 0.74 MIF (0.56) MIFMAOBCYP26A1
SCHEMBL6239187 0.74 MIF (0.64) MIFMAOBCYP26A1NR3C2NR3C1
SCHEMBL4037187 0.73 MIF (0.67) MIFMAOBNR3C2NR3C1PGR
SCHEMBL4162183 0.73 MIF (0.54) MIFMAOBNR3C2NR3C1PGR
SCHEMBL4161354 0.72 MIF (0.54) MIFMAOBTYRNR3C2NR3C1
SCHEMBL13802270 0.72 MIF (0.54) MIFMAOBTYRNR3C2NR3C1

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
US-20090149445-A1 TRICYCLIC STEROID HORMONE NUCLEAR RECEPTOR MODULATORS COGHLAN MICHAEL JOSEPH 2009-06-11 US disclosed
US-20090149445-A1 TRICYCLIC STEROID HORMONE NUCLEAR RECEPTOR MODULATORS COGHLAN MICHAEL JOSEPH 2009-06-11 US disclosed
US-20090149445-A1 TRICYCLIC STEROID HORMONE NUCLEAR RECEPTOR MODULATORS COGHLAN MICHAEL JOSEPH 2009-06-11 US disclosed
US-7411072-B2 Tricyclic steroid hormone nuclear receptor modulators ELI LILLY AND COMPANY (US) 2008-08-12 US disclosed
US-7411072-B2 Tricyclic steroid hormone nuclear receptor modulators ELI LILLY AND COMPANY (US) 2008-08-12 US disclosed
US-7411072-B2 Tricyclic steroid hormone nuclear receptor modulators ELI LILLY AND COMPANY (US) 2008-08-12 US disclosed
US-20060063759-A1 Tricyclic steroid hormone nuclear receptor modulators ELI LILLY AND COMPANY 2006-03-23 US disclosed
WO-2004052847-A2 TRICYCLIC STEROID HORMONE NUCLEAR RECEPTOR MODULATORS ELI LILLY AND COMPANY (US) 2004-06-24 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-20090149445-A1 TRICYCLIC STEROID HORMONE NUCLEAR RECEPTOR MODULATORS NR5A1, NR3C2, NR3C1 MIF 1642/4885MAOB 2154/4885TYR 4387/4885
US-20060063759-A1 Tricyclic steroid hormone nuclear receptor modulators NR5A1, NR3C2, NR3C1 MIF 1592/4885MAOB 2012/4885TYR 4184/4885

“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.