SCHEMBL12568629

SCHEMBL12568629

CCCCCCc1ccc(N2C(=O)CC[C@@H]2C=O)cc1

nearest known ligand 0.49

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
FAAH O00519 1/20 0.49
MGLL Q99685 1/20 0.49
PTGER2 P43116 5/20 0.42
PTGER4 P35408 3/20 0.42
SPHK1 Q9NYA1 4/20 0.42
PTGER3 P43115 3/20 0.42
S1PR1 P21453 5/20 0.41
ENPP2 Q13822 1/20 0.41
S1PR3 Q99500 3/20 0.40
S1PR4 O95977 2/20 0.40
S1PR5 Q9H228 2/20 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
SCHEMBL14444576 1.00 FAAH (0.49) FAAHMGLLPTGER2PTGER4SPHK1
SCHEMBL13693307 1.00 FAAH (0.49) FAAHMGLLPTGER2PTGER4SPHK1
SCHEMBL12112012 0.90 FAAH (0.47) FAAHMGLLPTGER2PTGER4SPHK1
SCHEMBL13747015 0.90 FAAH (0.47) FAAHMGLLPTGER2PTGER4SPHK1
SCHEMBL12621415 0.83 FAAH (0.50) FAAHMGLLPTGER2PTGER4SPHK1
SCHEMBL12112017 0.81 SPHK1 (0.52) FAAHMGLLPTGER2PTGER4SPHK1
SCHEMBL12568637 0.81 SPHK1 (0.52) FAAHMGLLPTGER2PTGER4SPHK1
SCHEMBL13693325 0.77 PTGER2 (0.75) PTGER2PTGER4PTGER3
SCHEMBL13780837 0.77 PTGER2 (0.65) PTGER2PTGER4PTGER3S1PR1
SCHEMBL13780848 0.77 PTGER2 (0.75) PTGER2PTGER4PTGER3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2121672-B1 SUBSTITUTED GAMMA LACTAMS AS THERAPEUTIC AGENTS ALLERGAN INC (US) 2014-12-10 EP disclosed
US-8377984-B2 Substituted gamma lactams as therapeutic agents ALLERGAN, INC. (US) 2013-02-19 US disclosed
US-8377984-B2 Substituted gamma lactams as therapeutic agents ALLERGAN, INC. (US) 2013-02-19 US disclosed
US-7960381-B2 Substituted gamma lactams as therapeutic agents ALLERGAN, INC. (US) 2011-06-14 US disclosed
US-7960381-B2 Substituted gamma lactams as therapeutic agents ALLERGAN, INC. (US) 2011-06-14 US disclosed
US-20100093729-A1 SUBSTITUTED GAMMA LACTAMS AS THERAPEUTIC AGENTS ALLERGAN, INC. (US) 2010-04-15 US disclosed
US-20100093729-A1 SUBSTITUTED GAMMA LACTAMS AS THERAPEUTIC AGENTS ALLERGAN, INC. (US) 2010-04-15 US disclosed
WO-2009097223-A1 SUBSTITUTED GAMMA LACTAMS AS THERAPEUTIC AGENTS ALLERGAN, INC. (US) 2009-08-06 WO disclosed
US-20090192159-A1 SUBSTITUTED GAMMA LACTAMS AS THERAPEUTIC AGENTS ALLERGAN, INC. 2009-07-30 US disclosed
US-20090192159-A1 SUBSTITUTED GAMMA LACTAMS AS THERAPEUTIC AGENTS ALLERGAN, INC. 2009-07-30 US disclosed
WO-2008094912-A2 SUBSTITUTED GAMMA LACTAMS AS THERAPEUTIC AGENTS ALLERGAN, INC. (US) 2008-08-07 WO 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-20100093729-A1 SUBSTITUTED GAMMA LACTAMS AS THERAPEUTIC AGENTS GLA, GUSB, GANAB FAAH 3019/4885MGLL 1418/4885PTGER2 2460/4885
US-20090192159-A1 SUBSTITUTED GAMMA LACTAMS AS THERAPEUTIC AGENTS GLA, B3GAT3, TGM1 FAAH 3057/4885MGLL 929/4885PTGER2 2641/4885

“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.