SCHEMBL14094306

SCHEMBL14094306

CC(=O)Oc1ccc2c(c1)C(=O)CC1C2CC[C@@]2(C)C1CC[C@@H]2O

nearest known ligand 0.72

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 4/20 0.72
ESR1 P03372 3/20 0.72
MAPK1 P28482 1/20 0.72
SMN1; SMN2 Q16637 3/20 0.68
ADORA3 P0DMS8 2/20 0.68
ATM Q13315 2/20 0.68
PGR P06401 1/20 0.68
AR P10275 1/20 0.68
CHRM1 P11229 1/20 0.68
TBXA2R P21731 1/20 0.68
ADRA1A P35348 1/20 0.68
OPRM1 P35372 1/20 0.68
SLC6A3 Q01959 1/20 0.68
TP53 P04637 1/20 0.53
CYP3A4 P08684 1/20 0.53
MAPT P10636 1/20 0.53
NR3C1 P04150 1/20 0.53
SHBG P04278 1/20 0.53
FYN P06241 1/20 0.53
ADRA2C P18825 1/20 0.53

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
SCHEMBL3347112 0.89 LMNA (0.76) LMNAESR1MAPK1SMN1; SMN2ADORA3
SCHEMBL30257967 0.88 MAPT (0.69) LMNAESR1MAPK1SMN1; SMN2ADORA3
SCHEMBL14094305 0.88 MAPT (0.69) LMNAESR1MAPK1SMN1; SMN2ADORA3
SCHEMBL5190949 0.88 MAPT (0.69) LMNAESR1MAPK1SMN1; SMN2ADORA3
SCHEMBL8944461 0.88 LMNA (0.71) LMNAESR1MAPK1SMN1; SMN2ADORA3
SCHEMBL11784135 0.87 ESR1 (0.53) LMNAESR1MAPK1SMN1; SMN2ADORA3
SCHEMBL15110529 0.84 ESR1 (1.00) LMNAESR1MAPK1SMN1; SMN2PGR
SCHEMBL2542940 0.84 ESR1 (1.00) LMNAESR1MAPK1SMN1; SMN2PGR
SCHEMBL20975754 0.84 ESR1 (1.00) LMNAESR1MAPK1SMN1; SMN2PGR
SCHEMBL13199986 0.84 ESR1 (1.00) LMNAESR1MAPK1SMN1; SMN2PGR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080200441-A1 ESTROGEN RECEPTOR MODULATORS ASSOCIATED PHARMACEUTICAL COMPOSITIONS AND METHODS OF USE UNIVERSITY OF SOUTHERN CALIFORNIA 2008-08-21 US disclosed
US-20080200441-A1 ESTROGEN RECEPTOR MODULATORS ASSOCIATED PHARMACEUTICAL COMPOSITIONS AND METHODS OF USE UNIVERSITY OF SOUTHERN CALIFORNIA 2008-08-21 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-20080200441-A1 ESTROGEN RECEPTOR MODULATORS ASSOCIATED PHARMACEUTICAL COMPOSITIONS AND METHODS OF USE ESR1, ESR2, GPER1 LMNA 1575/4885ESR1 1/4885MAPK1 3574/4885

“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.