SCHEMBL5503090

SCHEMBL5503090

Cc1c(Cl)c(Br)cc2c1NC(C)(C)CC2C

nearest known ligand 0.51

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
AR P10275 9/20 0.51
PGR P06401 15/20 0.45
NR3C1 P04150 13/20 0.39
NR3C2 P08235 3/20 0.38
ALDH1A1 P00352 1/20 0.38
HTT P42858 1/20 0.38

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
SCHEMBL5499279 0.78 PGR (0.54) ARPGRNR3C1NR3C2
SCHEMBL5502338 0.75 AR (0.47) ARPGRNR3C1NR3C2ALDH1A1
SCHEMBL5499823 0.74 NR3C1 (0.53) ARPGRNR3C1NR3C2
SCHEMBL5499820 0.74 NR3C1 (0.53) ARPGRNR3C1NR3C2
SCHEMBL5499824 0.74 NR3C1 (0.53) ARPGRNR3C1NR3C2
SCHEMBL10841346 0.73 AR (0.45) ARPGRNR3C1NR3C2ALDH1A1
SCHEMBL5503018 0.72 CREBBP (0.43) ARPGRNR3C1NR3C2
SCHEMBL10716320 0.71 PGR (0.43) ARPGRNR3C1NR3C2ALDH1A1
SCHEMBL10840472 0.71 MEN1 (0.51) ARPGRNR3C1NR3C2ALDH1A1
SCHEMBL5496745 0.71 NR3C1 (0.71) ARPGRNR3C1NR3C2

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-20070254917-A1 INTRACELLULAR RECEPTOR MODULATOR COMPOUNDS AND METHODS LIGAND PHARMACEUTICALS INC. 2007-11-01 US disclosed
EP-1778233-A1 INTRACELLULAR RECEPTOR MODULATOR COMPOUNDS AND METHODS LIGAND PHARMACEUTICALS, INC. (US) 2007-05-02 EP disclosed
WO-2006019716-A1 INTRACELLULAR RECEPTOR MODULATOR COMPOUNDS AND METHODS LIGAND PHARMACEUTICALS, INC. (US) 2006-02-23 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-20070254917-A1 INTRACELLULAR RECEPTOR MODULATOR COMPOUNDS AND METHODS CASR, GRK2, RYR2 AR 486/4885PGR 953/4885NR3C1 533/4885

“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.