SCHEMBL16675239

SCHEMBL16675239

CC(C)(C)OC(=O)CCNC(=O)C(C)(C)C

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MLYCD O95822 1/20 0.41
EPHX2 P34913 1/20 0.39
POLB P06746 1/20 0.39
CA14 Q9ULX7 1/20 0.38
TDP1 Q9NUW8 1/20 0.38
GAA P10253 2/20 0.36
MEN1 O00255 1/20 0.36
KMT2A Q03164 1/20 0.36
KDM4E B2RXH2 2/20 0.35
MAPT P10636 2/20 0.35
ALDH1A1 P00352 1/20 0.35
GLA P06280 1/20 0.35
HPGD P15428 1/20 0.35
HIF1A Q16665 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.33
DGAT1 O75907 1/20 0.33
MAOA P21397 1/20 0.33
MAOB P27338 1/20 0.33
CYP2D6 P10635 1/20 0.33
ELANE P08246 1/20 0.33

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
SCHEMBL2553927 0.85 MLYCD (0.39) MLYCDEPHX2CA14TDP1GAA
SCHEMBL1709311 0.83 TSHR (0.50) EPHX2POLBCA14GAAMEN1
SCHEMBL20043753 0.82 POLB (0.40) EPHX2POLBCA14KDM4EMAPT
SCHEMBL8645031 0.82 KDM4E (0.43) MLYCDEPHX2TDP1GAAMEN1
SCHEMBL2799440 0.82 TDP1 (0.56) MLYCDEPHX2TDP1GAAMEN1
SCHEMBL20043191 0.81 PTPRC (0.39) POLBCA14TDP1GAAMEN1
SCHEMBL10289897 0.80 MLYCD (0.42) MLYCDEPHX2POLBCA14TDP1
SCHEMBL7664928 0.80 MLYCD (0.41) MLYCDEPHX2CA14TDP1GAA
SCHEMBL14396534 0.80 MLYCD (0.41) MLYCDEPHX2CA14TDP1GAA
Hydrochloric Acid SCHEMBL7451357 0.80 MLYCD (0.41) MLYCDEPHX2TDP1GAAMEN1

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-10017522-B2 Alpha helix mimetics and methods relating thereto Prism BioLab Co., Ltd. (JP) 2018-07-10 US disclosed
US-20150119344-A1 COMPOSITIONS AND METHODS FOR THE TREATMENT OF CARDIOVASCULAR AND NEUROLOGICAL DISEASES KANDULA MAHESH (IN) 2015-04-30 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 (2 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-20150119344-A1 COMPOSITIONS AND METHODS FOR THE TREATMENT OF CARDIOVASCULAR AND NEUROLOGICAL DISEASES IAPP, SLC5A1, GPR119 MLYCD 1546/4885EPHX2 2136/4885POLB 1268/4885
US-10017522-B2 Alpha helix mimetics and methods relating thereto PLOD3, COL1A1, THPO MLYCD 2835/4885EPHX2 316/4885POLB 2747/4885

“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.