SCHEMBL6313868

SCHEMBL6313868

CC(C)(C)OC(=O)CCCOc1cccc(C=O)c1

nearest known ligand 0.46

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MAOA P21397 7/20 0.46
MAOB P27338 7/20 0.46
CYSLTR2 Q9NS75 3/20 0.45
CYSLTR1 Q9Y271 3/20 0.45
NPC1 O15118 2/20 0.45
RAB9A P51151 2/20 0.45
TDP1 Q9NUW8 1/20 0.45
SRC P12931 1/20 0.41
TLR4 O00206 1/20 0.40
TLR2 O60603 1/20 0.40
KDM4E B2RXH2 1/20 0.40
ALDH1A1 P00352 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
HPGD P15428 1/20 0.40

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
SCHEMBL20211841 0.95 MAOA (0.44) MAOAMAOBCYSLTR2CYSLTR1NPC1
SCHEMBL20211844 0.95 MAOA (0.44) MAOAMAOBCYSLTR2CYSLTR1NPC1
SCHEMBL20211726 0.85 NPC1 (0.51) MAOAMAOBCYSLTR2CYSLTR1NPC1
SCHEMBL528101 0.85 MAOA (0.49) MAOAMAOBCYSLTR2CYSLTR1NPC1
SCHEMBL4253341 0.84 CYSLTR2 (0.60) MAOAMAOBCYSLTR2CYSLTR1NPC1
SCHEMBL21577271 0.83 CHRNB2 (0.51) CYSLTR2CYSLTR1SMN1; SMN2
SCHEMBL13986556 0.82 SMN1; SMN2 (0.58) NPC1RAB9ATDP1ALDH1A1SMN1; SMN2
SCHEMBL7254082 0.82 PTGER4 (0.44) MAOAMAOBCYSLTR2CYSLTR1NPC1
SCHEMBL4833474 0.81 ALDH1A1 (0.53) RAB9ATDP1KDM4EALDH1A1
SCHEMBL21160682 0.81 CA12 (0.54) MAOAMAOB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4279490-A2 CELL IMPERMEABLE COELENTERAZINE ANALOGUES Promega Corporation (US) 2023-11-22 EP disclosed
EP-3548492-B1 CELL IMPERMEABLE COELENTERAZINE ANALOGUES PROMEGA CORP (US) 2023-07-05 EP disclosed
US-11192894-B2 Cell impermeable coelenterazine analogues PROMEGA CORPORATION (US) 2021-12-07 US disclosed
US-20200239475-A1 CELL IMPERMEABLE COELENTERAZINE ANALOGUES PROMEGA CORPORATION 2020-07-30 US disclosed
US-10577370-B2 Cell impermeable coelenterazine analogues PROMEGA CORPORATION (US) 2020-03-03 US disclosed
EP-3548492-A1 CELL IMPERMEABLE COELENTERAZINE ANALOGUES Promega Corporation (US) 2019-10-09 EP disclosed
WO-2018102693-A1 CELL IMPERMEABLE COELENTERAZINE ANALOGUES PROMEGA CORPORATION (US) 2018-06-07 WO disclosed
US-20180155350-A1 CELL IMPERMEABLE COELENTERAZINE ANALOGUES JPMORGAN CHASE BANK, N.A., AS COLLATERAL AGENT 2018-06-07 US disclosed
US-20050014810-A1 Use of substituted 2 phenylbenzimidazoles as medicaments BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2005-01-20 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 (5 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-11192894-B2 Cell impermeable coelenterazine analogues SI, GLB1, MRPL21 MAOA 4388/4885MAOB 3860/4885CYSLTR2 2079/4885
US-10577370-B2 Cell impermeable coelenterazine analogues SI, GLB1, MRPL21 MAOA 4388/4885MAOB 3860/4885CYSLTR2 2079/4885
US-20200239475-A1 CELL IMPERMEABLE COELENTERAZINE ANALOGUES SI, GLB1, MRPL21 MAOA 4388/4885MAOB 3860/4885CYSLTR2 2079/4885
US-20050014810-A1 Use of substituted 2 phenylbenzimidazoles as medicaments GLP1R, GIPR, GCGR MAOA 2189/4885MAOB 1115/4885CYSLTR2 446/4885
US-20180155350-A1 CELL IMPERMEABLE COELENTERAZINE ANALOGUES SI, GLB1, MRPL21 MAOA 4388/4885MAOB 3860/4885CYSLTR2 2079/4885

“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.