SCHEMBL15029058

SCHEMBL15029058

C=Cc1c(C(C)C)nc(C(C)C)c(COC)c1-c1ccc(F)cc1

nearest known ligand 0.73

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
GCGR P47871 19/20 0.73
ESR1 P03372 1/20 0.61
HMGCR P04035 1/20 0.61
CHRM1 P11229 1/20 0.61
TBXA2R P21731 1/20 0.61
PDE4A P27815 1/20 0.61
ADRA1A P35348 1/20 0.61

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
SCHEMBL7077308 0.88 GCGR (0.67) GCGRESR1HMGCRCHRM1TBXA2R
SCHEMBL13302217 0.87 GCGR (0.63) GCGRESR1HMGCRCHRM1TBXA2R
SCHEMBL7720729 0.87 GCGR (0.86) GCGRESR1HMGCRCHRM1TBXA2R
SCHEMBL12074145 0.86 GCGR (0.66) GCGRESR1HMGCRCHRM1TBXA2R
SCHEMBL13302216 0.86 GCGR (0.62) GCGRESR1HMGCRCHRM1TBXA2R
SCHEMBL12215998 0.85 ESR1 (0.67) GCGRESR1HMGCRCHRM1TBXA2R
SCHEMBL22894610 0.85 GCGR (0.76) GCGRESR1HMGCRCHRM1TBXA2R
SCHEMBL2648452 0.85 GCGR (1.00) GCGR
SCHEMBL3445407 0.84 GCGR (0.78) GCGRESR1HMGCRCHRM1TBXA2R
SCHEMBL7561153 0.83 ESR1 (0.62) GCGRESR1HMGCRCHRM1TBXA2R

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-20230116399-A1 Tumor Homing Statin Derivatives Da Zen Theranostics, Inc. (US) 2023-04-13 US disclosed
EP-3763389-A1 TUMOR HOMING STATIN DERIVATIVES Da Zen Theranostics Inc. (US) 2021-01-13 EP disclosed
WO-2013083718-A1 PROCESS FOR THE PREPARATION OF A STATIN PRECURSOR DSM SINOCHEM PHARMACEUTICALS NETHERLANDS B.V. (NL) 2013-06-13 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-20230116399-A1 Tumor Homing Statin Derivatives HMGCR, DHCR7, DHODH GCGR 3187/4885ESR1 1716/4885HMGCR 1/4885

“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.