SCHEMBL3963233

SCHEMBL3963233

CCCCCCCCCN(Cc1ccc(F)cc1F)C(=O)COc1ccc(C[C@H](OCC)C(=O)OCC)cc1

nearest known ligand 0.42

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
HTR2A P28223 7/20 0.42
PPARA Q07869 8/20 0.39
PPARG P37231 6/20 0.39
SOAT1 P35610 1/20 0.39
USP2 O75604 1/20 0.38
HSD17B10 Q99714 1/20 0.38
LTB4R2 Q9NPC1 1/20 0.38
PPARD Q03181 3/20 0.37
MME P08473 1/20 0.37
ACE P12821 1/20 0.37
CPA1 P15085 1/20 0.37
ACE2 Q9BYF1 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
SCHEMBL3965289 1.00 HTR2A (0.42) HTR2APPARAPPARGSOAT1USP2
SCHEMBL3964918 1.00 HTR2A (0.42) HTR2APPARAPPARGSOAT1USP2
SCHEMBL3962800 0.92 PPARA (0.47) HTR2APPARAPPARGPPARD
SCHEMBL4073462 0.92 PPARA (0.47) HTR2APPARAPPARGPPARD
SCHEMBL3963764 0.92 PPARA (0.47) HTR2APPARAPPARGPPARD
SCHEMBL3965062 0.92 PPARA (0.47) HTR2APPARAPPARGPPARD
SCHEMBL3968805 0.89 PPARA (0.48) HTR2APPARAPPARGUSP2HSD17B10
SCHEMBL3956930 0.87 MAPT (0.41) HTR2APPARAPPARGPPARDMME
SCHEMBL3960456 0.87 FFAR1 (0.43) HTR2APPARAPPARGUSP2HSD17B10
SCHEMBL3960794 0.83 TRPM8 (0.52) PPARAPPARGLTB4R2PPARD

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-7488844-B2 Therapeutic agents ASTRAZENECA AB (SE) 2009-02-10 US disclosed
US-20050282822-A1 Therapeutic agents ASTRAZENECA AB (SE) 2005-12-22 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-20050282822-A1 Therapeutic agents GPR119, LIPC, PNLIP HTR2A 4493/4885PPARA 346/4885PPARG 228/4885

“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.