SCHEMBL17860960

SCHEMBL17860960

CCCOP(=O)(O)CCC(C)=O

nearest known ligand 0.46

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
PPARD Q03181 1/20 0.41
CETP P11597 4/20 0.37
LPAR3 Q9UBY5 3/20 0.35
LPAR1 Q92633 2/20 0.35
LPAR2 Q9HBW0 2/20 0.35
ALDH1A1 P00352 1/20 0.35
MEN1 O00255 1/20 0.32
KMT2A Q03164 1/20 0.32

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
SCHEMBL17860894 0.82 PPARD (0.39) PPARDCETPLPAR3LPAR1LPAR2
SCHEMBL2990566 0.82 PPARD (0.39) PPARDLPAR3LPAR1LPAR2ALDH1A1
SCHEMBL779021 0.81 LPAR3 (0.48) PPARDCETPLPAR3LPAR1LPAR2
SCHEMBL7636250 0.81 PPARD (0.48) PPARDCETPLPAR3LPAR1LPAR2
SCHEMBL17878630 0.79 PPARD (0.37) PPARDCETPLPAR3LPAR1LPAR2
SCHEMBL28663420 0.78 CETP (0.57) CETPLPAR3LPAR1LPAR2
SCHEMBL899361 0.78 PPARD (0.52) PPARDCETPLPAR3LPAR1LPAR2
SCHEMBL2992408 0.74 PPARD (0.36) PPARDLPAR3LPAR1LPAR2ALDH1A1
SCHEMBL777791 0.73
SCHEMBL812032 0.72 CYP3A4 (0.56) PPARDCETPLPAR3LPAR1LPAR2

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-9771394-B2 Antimicrobial polymyxins for treatment of bacterial infections MICURX PHARMACEUTICALS, INC. (KY) 2017-09-26 US disclosed
US-20160185823-A1 ANTIMICROBIAL POLYMYXINS FOR TREATMENT OF BACTERIAL INFECTIONS MICURX PHARMACEUTICALS, INC. 2016-06-30 US disclosed
WO-2016100578-A2 ANTIMICROBIAL POLYMYXINS FOR TREATMENT OF BACTERIAL INFECTIONS MICURX PHARMACEUTICALS, INC. (US) 2016-06-23 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-20160185823-A1 ANTIMICROBIAL POLYMYXINS FOR TREATMENT OF BACTERIAL INFECTIONS VIP, AQP1, PEF1 PPARD 1269/4885CETP 78/4885LPAR3 2783/4885

“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.