SCHEMBL569250

SCHEMBL569250

CC(C)(C)OC(=O)C(N)(CCN)C(=O)OC(C)(C)C

nearest known ligand 0.45

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
DGAT1 O75907 1/20 0.45
CA2 P00918 2/20 0.33
CA12 O43570 2/20 0.33
CA14 Q9ULX7 2/20 0.33
TDP1 Q9NUW8 1/20 0.32
MAOA P21397 1/20 0.32
MAOB P27338 1/20 0.32
CA1 P00915 2/20 0.32
CA7 P43166 2/20 0.32
GAA P10253 2/20 0.31
MEN1 O00255 1/20 0.31
KMT2A Q03164 1/20 0.31
APLNR P35414 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
SCHEMBL7705520 0.90 DGAT1 (0.41) DGAT1CA2CA12CA14TDP1
SCHEMBL1066048 0.90 DGAT1 (0.41) DGAT1CA2CA12CA14TDP1
SCHEMBL3294151 0.88 DGAT1 (0.38) DGAT1TDP1MAOAMAOB
SCHEMBL7802855 0.86 DGAT1 (0.36) DGAT1MEN1KMT2A
SCHEMBL5027322 0.85 DGAT1 (0.46) DGAT1TDP1MAOAMAOB
SCHEMBL9196272 0.84 PAOX (0.36) DGAT1TDP1MAOAMAOBMEN1
SCHEMBL587833 0.84 PAOX (0.36) DGAT1TDP1MAOAMAOBMEN1
SCHEMBL20496960 0.84 PAOX (0.36) DGAT1TDP1MAOAMAOBMEN1
SCHEMBL19065775 0.84 DGAT1 (0.44) DGAT1TDP1
SCHEMBL3547991 0.83 DGAT1 (0.45) DGAT1CA2CA12CA14TDP1

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 7 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2970586-B1 AMINE FUNCTIONAL POLYAMIDES GENZYME CORP (US) 2022-12-07 EP disclosed
EP-2968231-B1 ANTIMICROBIAL POLYAMIDE COMPOSITIONS AND MASTITIS TREATMENT BOEHRINGER INGELHEIM ANIMAL HEALTH USA INC (US) 2020-07-01 EP disclosed
EP-2968231-A1 ANTIMICROBIAL POLYAMIDE COMPOSITIONS AND MASTITIS TREATMENT Merial, Inc. (US) 2016-01-20 EP disclosed
EP-2970586-A1 AMINE FUNCTIONAL POLYAMIDES Genzyme Corporation (US) 2016-01-20 EP disclosed
WO-2014150451-A1 ANTIMICROBIAL POLYAMIDE COMPOSITIONS AND MASTITIS TREATMENT MERIAL LIMITED (US) 2014-09-25 WO disclosed
WO-2014150338-A1 AMINE FUNCTIONAL POLYAMIDES GENZYME CORPORATION (US) 2014-09-25 WO disclosed
US-20120035140-A1 CARBAMOYLPHOSPHONATES AS INHIBITORS AND USES THEREOF YISSUM RESEARCH DEVELOPMENT COMPANY OF THE HEBREW UNIVERSITY OF JERUSALEM, LTD. (IL) 2012-02-09 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-20120035140-A1 CARBAMOYLPHOSPHONATES AS INHIBITORS AND USES THEREOF MMP9, MMP26, MMP25 DGAT1 2256/4885CA2 91/4885CA12 307/4885

“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.