SCHEMBL5597540

SCHEMBL5597540

C=CCC1CCN(C(=O)O)C1=O

nearest known ligand 0.51

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
FAAH O00519 5/20 0.51
ACE P12821 3/20 0.36
NOS1 P29475 2/20 0.33
NOS2 P35228 2/20 0.33
MEN1 O00255 1/20 0.33
ALDH1A1 P00352 1/20 0.33
KMT2A Q03164 1/20 0.33
ELANE P08246 8/20 0.32
CTSG P08311 3/20 0.32
MGLL Q99685 1/20 0.31
F2 P00734 3/20 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
SCHEMBL626378 0.77 FAAH (0.43) FAAHELANECTSG
SCHEMBL3226035 0.77 ACE (0.39) FAAHACE
SCHEMBL169033 0.77 CYP3A4 (0.44) FAAHACENOS1NOS2MEN1
SCHEMBL5691751 0.77 FAAH (0.34) FAAHMGLL
SCHEMBL28017368 0.75 ACE (0.38) FAAHACEKMT2A
SCHEMBL1645972 0.73 FAAH (0.40) FAAHNOS1NOS2MEN1ALDH1A1
SCHEMBL360776 0.73 FAAH (0.40) FAAHNOS1NOS2MEN1ALDH1A1
SCHEMBL6338204 0.72 ELANE (0.38) FAAHACEMEN1ALDH1A1KMT2A
SCHEMBL26361631 0.71 FAAH (0.39) FAAHACENOS1NOS2MEN1
SCHEMBL27742564 0.71 ACE (0.35) ACE

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9169240-B2 Ketone linked benzothiazole inhibitors of endothelial lipase BRISTOL-MYERS SQUIBB COMPANY (US) 2015-10-27 US disclosed
US-20150239879-A1 KETONE LINKED BENZOTHIAZOLE INHIBITORS OF ENDOTHELIAL LIPASE BRISTOL-MYERS SQUIBB COMPANY 2015-08-27 US disclosed
EP-2895483-A1 KETONE LINKED BENZOTHIAZOLE INHIBITORS OF ENDOTHELIAL LIPASE Bristol-Myers Squibb Company (US) 2015-07-22 EP disclosed
WO-2014042939-A1 KETONE LINKED BENZOTHIAZOLE INHIBITORS OF ENDOTHELIAL LIPASE BRISTOL-MYERS SQUIBB COMPANY (US) 2014-03-20 WO disclosed
JP-2007284648-A METHOD FOR TREATING POLYVINYL BUTYRAL RESIN AS INTERLAYER FILM OF AUTOMOBILE GLASS LAMINATE RAKU:KK 2007-11-01 JP 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-20150239879-A1 KETONE LINKED BENZOTHIAZOLE INHIBITORS OF ENDOTHELIAL LIPASE LIPG, LPL, LIPE FAAH 176/4885ACE 140/4885NOS1 1527/4885

“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.