SCHEMBL5540412

SCHEMBL5540412

CC1(C)C[C@@](O)(C(F)(F)F)[C@@H](NC(=O)c2ccc3ccccc3c2)c2ccc(F)c(O)c21

nearest known ligand 0.50

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
NR3C1 P04150 3/20 0.50
PGR P06401 2/20 0.50
AR P10275 2/20 0.50
DRD4 P21917 3/20 0.37
MCHR1 Q99705 2/20 0.37
DRD2 P14416 1/20 0.37
DRD3 P35462 1/20 0.37
MEN1 O00255 1/20 0.37
KMT2A Q03164 1/20 0.37
HSD17B14 Q9BPX1 1/20 0.37
RAB9A P51151 1/20 0.36
TAS1R3 Q7RTX0 1/20 0.36
TAS1R1 Q7RTX1 1/20 0.36
TAS1R2 Q8TE23 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
SCHEMBL5540419 1.00 NR3C1 (0.50) NR3C1PGRARDRD4MCHR1
SCHEMBL5540438 1.00 NR3C1 (0.50) NR3C1PGRARDRD4MCHR1
SCHEMBL5540427 1.00 NR3C1 (0.50) NR3C1PGRARDRD4MCHR1
SCHEMBL5540442 1.00 NR3C1 (0.50) NR3C1PGRARDRD4MCHR1
SCHEMBL14496148 0.88 MCHR1 (0.40) NR3C1PGRARDRD4MCHR1
SCHEMBL5540222 0.88 MCHR1 (0.40) NR3C1PGRARDRD4MCHR1
SCHEMBL5540217 0.88 MCHR1 (0.40) NR3C1PGRARDRD4MCHR1
SCHEMBL5534973 0.85 CHRNA7 (0.46) NR3C1PGRARTAS1R3TAS1R1
SCHEMBL5537977 0.85 CHRNA7 (0.46) NR3C1PGRARTAS1R3TAS1R1
SCHEMBL5534982 0.85 CHRNA7 (0.46) NR3C1PGRARTAS1R3TAS1R1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20070129359-A1 Tetrahydronaphthalene derivatives, processes for their preparation and their use as antiinflammatory agents SCHERING AG (DE) 2007-06-07 US disclosed
US-20070129359-A1 Tetrahydronaphthalene derivatives, processes for their preparation and their use as antiinflammatory agents SCHERING AG (DE) 2007-06-07 US disclosed
US-20070129359-A1 Tetrahydronaphthalene derivatives, processes for their preparation and their use as antiinflammatory agents SCHERING AG (DE) 2007-06-07 US 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-20070129359-A1 Tetrahydronaphthalene derivatives, processes for their preparation and their use as antiinflammatory agents TNF, IL1B, PTGS1 NR3C1 190/4885PGR 2358/4885AR 2736/4885

“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.