SCHEMBL7196166

SCHEMBL7196166

COCC1CC[C@H]2[C@@H]3CCC4CC(=O)C=C[C@]4(C)[C@@H]3CC[C@]12C

nearest known ligand 0.67

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
AR P10275 3/20 0.44
KCNH2 Q12809 1/20 0.44
GRIN1 Q05586 1/20 0.38
GRIN2B Q13224 1/20 0.38
NR3C1 P04150 1/20 0.37
SHBG P04278 1/20 0.37
PGR P06401 1/20 0.37
SERPINA6 P08185 1/20 0.37
NR3C2 P08235 1/20 0.37
CYP3A4 P08684 1/20 0.37
CYP19A1 P11511 1/20 0.37
GPBAR1 Q8TDU6 1/20 0.37
HSD17B10 Q99714 1/20 0.37
MGAM O43451 1/20 0.37
SRD5A1 P18405 1/20 0.37

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
SCHEMBL7196165 1.00 AR (0.44) ARKCNH2GRIN1GRIN2BNR3C1
SCHEMBL3486294 0.87 GRIN1 (0.47) ARGRIN1GRIN2BNR3C1SHBG
SCHEMBL7197702 0.83 AR (0.42) ARGPBAR1
SCHEMBL7515861 0.83 MEN1 (0.40) ARKCNH2NR3C1PGRCYP3A4
SCHEMBL7515870 0.83 MEN1 (0.40) ARKCNH2NR3C1PGRCYP3A4
SCHEMBL11329429 0.83 AR (0.42) ARNR3C1SHBGPGRSERPINA6
SCHEMBL11329447 0.83 AR (0.42) ARNR3C1SHBGPGRSERPINA6
SCHEMBL7195422 0.82 GPBAR1 (0.43) ARGPBAR1HSD17B10
SCHEMBL21807712 0.81 AR (0.45) ARKCNH2GRIN1GRIN2BNR3C1
SCHEMBL8898529 0.81 AR (0.45) ARKCNH2GRIN1GRIN2BNR3C1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20030134828-A1 Composition and method for increasing in vivo androgen concentration ROBERTS WILLIAM J (US) 2003-07-17 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-20030134828-A1 Composition and method for increasing in vivo androgen concentration SHBG, CYP21A2, CYP19A1 AR 6/4885KCNH2 4598/4885GRIN1 3463/4885

“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.