SCHEMBL3417092

SCHEMBL3417092

N#Cc1ccc(N(CCc2ccc(F)cc2)C(=O)CNCC2CC2)cc1C(F)(F)F

nearest known ligand 0.40

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
AR P10275 14/20 0.40
CNR2 P34972 1/20 0.40
RXRA P19793 1/20 0.38
RXRB P28702 1/20 0.38
RXRG P48443 1/20 0.38
PGR P06401 2/20 0.38
CYP2C19 P33261 1/20 0.36
ABCB11 O95342 1/20 0.36
ALB P02768 1/20 0.36
ADRA2C P18825 1/20 0.36
GHSR Q92847 1/20 0.36
GCGR P47871 1/20 0.35
GIPR P48546 1/20 0.35

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
SCHEMBL3410457 0.92 CNR2 (0.41) ARCNR2RXRARXRBRXRG
SCHEMBL3412274 0.91 CNR2 (0.41) ARCNR2RXRARXRBRXRG
SCHEMBL3412152 0.86 AR (0.43) ARRXRARXRBRXRGPGR
SCHEMBL3410653 0.85 CNR2 (0.44) ARCNR2RXRARXRBRXRG
SCHEMBL3288282 0.84 CNR2 (0.45) ARCNR2RXRARXRBRXRG
SCHEMBL3410635 0.82 UBE2M (0.44) ARCNR2RXRARXRBRXRG
SCHEMBL3290401 0.80 AR (0.47) ARCNR2RXRARXRBRXRG
SCHEMBL3417367 0.79 AR (0.42) ARRXRARXRBRXRGPGR
SCHEMBL3293347 0.78 AR (0.44) ARCNR2PGR
SCHEMBL3414127 0.77 CNR2 (0.44) ARCNR2RXRARXRBRXRG

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7834063-B2 4-[(Cyclopropylmethyl)(2-{[4-(1,1-dimethylethyl)phenyl]oxy}ethyl)amino]-2-(trifluoromethyl)benzonitrile; modulators of androgen, glucocorticoid, mineralocorticoid, and progesterone receptors; osteoporosis, muscle wasting,endometriosis, cardiovascular disease; breast, uterine cancer, prostatic hyperplasia GLAXOSMITHKLINE LLC (US) 2010-11-16 US claimed
US-20080255124-A1 Chemical Compounds SMITHKLINE BEECHAM CORPORATION (US) 2008-10-16 US claimed
US-7834063-B2 4-[(Cyclopropylmethyl)(2-{[4-(1,1-dimethylethyl)phenyl]oxy}ethyl)amino]-2-(trifluoromethyl)benzonitrile; modulators of androgen, glucocorticoid, mineralocorticoid, and progesterone receptors; osteoporosis, muscle wasting,endometriosis, cardiovascular disease; breast, uterine cancer, prostatic hyperplasia GLAXOSMITHKLINE LLC (US) 2010-11-16 US disclosed
US-20080255124-A1 Chemical Compounds SMITHKLINE BEECHAM CORPORATION (US) 2008-10-16 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-20080255124-A1 Chemical Compounds NR3C2, NR5A1, NR3C1 AR 4/4885CNR2 528/4885RXRA 244/4885

“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.