SCHEMBL17878616

SCHEMBL17878616

CCCOP(=O)(CC(=O)C(C)C)OCCC

nearest known ligand 0.36

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.32
KMT2A Q03164 1/20 0.32
LPAR3 Q9UBY5 3/20 0.31
LPAR1 Q92633 2/20 0.31
LPAR2 Q9HBW0 2/20 0.31
CYP3A4 P08684 1/20 0.31
LPAR5 Q9H1C0 1/20 0.31
HSD17B10 Q99714 1/20 0.30

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
SCHEMBL17878594 0.89 CYP3A4 (0.47) LPAR3LPAR1LPAR2CYP3A4
SCHEMBL7055977 0.83 TSHR (0.46) CYP3A4
SCHEMBL17878599 0.81 PPARD (0.35) MEN1KMT2A
SCHEMBL2994532 0.77 MEN1 (0.35) MEN1KMT2ALPAR3LPAR1LPAR2
SCHEMBL17860961 0.75 MEN1 (0.34) MEN1KMT2ALPAR3LPAR1LPAR2
SCHEMBL2990947 0.75 TDP1 (0.38) MEN1KMT2ALPAR3LPAR1LPAR2
SCHEMBL3939885 0.74 LMNA (0.31)
SCHEMBL15951719 0.73 POLB (0.39) MEN1KMT2ALPAR3LPAR1LPAR2
SCHEMBL2237874 0.73 NAAA (0.36) MEN1KMT2ALPAR3LPAR1LPAR2
SCHEMBL2351213 0.72 MGAM (0.43) CYP3A4HSD17B10

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-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

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 MEN1 2965/4885KMT2A 4316/4885LPAR3 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.