SCHEMBL13539743

SCHEMBL13539743

CCCCC1=NC2(CCCCC2)C(=O)N1Cc1ccc(-c2cc(O)ccc2F)cc1

nearest known ligand 0.65

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
AGTR1 P30556 3/20 0.65
LTB4R2 Q9NPC1 3/20 0.65
ACHE P22303 5/20 0.62
ABCC3 O15438 1/20 0.59
ABCC4 O15439 1/20 0.59
ABCB11 O95342 1/20 0.59
LMNA P02545 1/20 0.59
CYP3A4 P08684 1/20 0.59
GAA P10253 1/20 0.59
EDNRA P25101 1/20 0.59
MAPK1 P28482 1/20 0.59
HTR2B P41595 1/20 0.59
AGTR2 P50052 1/20 0.59
PDE3A Q14432 1/20 0.59
SLC10A1 Q14973 1/20 0.59

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
SCHEMBL13539758 0.89 AGTR1 (0.66) AGTR1LTB4R2ACHEABCC3ABCC4
SCHEMBL13539751 0.88 AGTR1 (0.65) AGTR1LTB4R2ACHEABCC3ABCC4
SCHEMBL13539734 0.88 ACHE (0.61) AGTR1LTB4R2ACHEABCC3ABCC4
SCHEMBL13539765 0.86 ACHE (0.77) AGTR1LTB4R2ACHEABCC3ABCC4
SCHEMBL13539763 0.85 AGTR1 (0.61) AGTR1LTB4R2ACHEABCC3ABCC4
SCHEMBL3483854 0.85 AGTR1 (0.47) AGTR1LTB4R2ACHE
SCHEMBL13539541 0.85 AGTR1 (0.62) AGTR1LTB4R2ACHEABCC3ABCC4
SCHEMBL13539542 0.84 AGTR1 (0.62) AGTR1LTB4R2ACHEABCC3ABCC4
SCHEMBL13539732 0.84 AGTR1 (0.66) AGTR1LTB4R2ACHEABCC3ABCC4
SCHEMBL13539544 0.84 AGTR1 (0.61) AGTR1LTB4R2ACHEABCC3ABCC4

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-20100004159-A1 SUBSTITUTED IMIDAZOLONE DERIVATIVES, PREPARATIONS AND USES GENFIT (FR) 2010-01-07 US disclosed
US-20100004159-A1 SUBSTITUTED IMIDAZOLONE DERIVATIVES, PREPARATIONS AND USES GENFIT (FR) 2010-01-07 US disclosed
WO-2008012470-A2 SUBSTITUTED IMIDAZOLONE DERIVATIVES, PREPARATION AND USES GENFIT (FR) 2008-01-31 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-20100004159-A1 SUBSTITUTED IMIDAZOLONE DERIVATIVES, PREPARATIONS AND USES IPO5, PPIP5K2, IPO4 AGTR1 1691/4885LTB4R2 3646/4885ACHE 2077/4885

“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.