SCHEMBL2991664

SCHEMBL2991664

CC(C)(C)c1ccc(N2C(=O)CC[C@H]2COCCCCC(=O)O)cc1

nearest known ligand 0.74

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
PTGER2 P43116 17/20 0.74
PTGER3 P43115 7/20 0.74
PTGDR Q13258 6/20 0.62
PTGER4 P35408 1/20 0.41
TBXA2R P21731 1/20 0.39
NR1H4 Q96RI1 1/20 0.38
MEN1 O00255 1/20 0.38
KMT2A Q03164 1/20 0.38
FABP3 P05413 1/20 0.37

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
SCHEMBL1311310 1.00 PTGER2 (0.74) PTGER2PTGER3PTGDRPTGER4TBXA2R
SCHEMBL12112053 0.93 PTGER2 (0.67) PTGER2PTGER3PTGDRPTGER4NR1H4
SCHEMBL14358803 0.93 PTGER2 (0.67) PTGER2PTGER3PTGDRPTGER4NR1H4
SCHEMBL13667628 0.87 PTGER2 (0.57) PTGER2PTGER3PTGDRPTGER4MEN1
SCHEMBL1310059 0.85 PTGER2 (1.00) PTGER2PTGER3PTGDRPTGER4TBXA2R
SCHEMBL1310058 0.85 PTGER2 (1.00) PTGER2PTGER3PTGDRPTGER4TBXA2R
SCHEMBL2992422 0.85 PTGER2 (1.00) PTGER2PTGER3PTGDRPTGER4TBXA2R
SCHEMBL13823435 0.84 PTGER2 (0.53) PTGER2PTGER3PTGDRPTGER4
SCHEMBL13181248 0.84 PTGER2 (0.53) PTGER2PTGER3PTGDRPTGER4
SCHEMBL13385600 0.79 PTGER2 (0.69) PTGER2PTGER3PTGDRTBXA2RNR1H4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7550502-B2 Substituted gamma lactams as therapeutic agents ALLERGAN, INC. (US) 2009-06-23 US claimed
EP-1996546-B1 SUBSTITUTED GAMMA LACTAMS AS PROSTAGLANDIN EP2 AGONISTS ALLERGAN INC (US) 2014-11-26 EP disclosed
US-7781482-B2 Substituted gamma lactams as therapeutic agents ALLERGAN, INC. (US) 2010-08-24 US disclosed
US-7781482-B2 Substituted gamma lactams as therapeutic agents ALLERGAN, INC. (US) 2010-08-24 US disclosed
US-7781482-B2 Substituted gamma lactams as therapeutic agents ALLERGAN, INC. (US) 2010-08-24 US disclosed
US-20090227653-A1 SUBSTITUTED GAMMA LACTAMS AS THERAPEUTIC AGENTS ALLERGAN, INC. (US) 2009-09-10 US disclosed
US-20090227653-A1 SUBSTITUTED GAMMA LACTAMS AS THERAPEUTIC AGENTS ALLERGAN, INC. (US) 2009-09-10 US disclosed
US-20090227653-A1 SUBSTITUTED GAMMA LACTAMS AS THERAPEUTIC AGENTS ALLERGAN, INC. (US) 2009-09-10 US disclosed
US-7550502-B2 Substituted gamma lactams as therapeutic agents ALLERGAN, INC. (US) 2009-06-23 US disclosed
US-7550502-B2 Substituted gamma lactams as therapeutic agents ALLERGAN, INC. (US) 2009-06-23 US disclosed
WO-2007109578-A2 SUBSTITUTED GAMMA LACTAMS AS PROSTAGLANDIN EP2 AGONISTS ALLERGAN, INC. (US) 2007-09-27 WO disclosed
US-20070219265-A1 SUBSTITUTED GAMMA LACTAMS AS THERAPEUTIC AGENTS ALLERGAN, INC. 2007-09-20 US disclosed
US-20070219265-A1 SUBSTITUTED GAMMA LACTAMS AS THERAPEUTIC AGENTS ALLERGAN, INC. 2007-09-20 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 (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-20090227653-A1 SUBSTITUTED GAMMA LACTAMS AS THERAPEUTIC AGENTS GLA, GUSB, GANAB PTGER2 3210/4885PTGER3 2745/4885PTGDR 1340/4885
US-20070219265-A1 SUBSTITUTED GAMMA LACTAMS AS THERAPEUTIC AGENTS GLA, GUSB, GANAB PTGER2 3210/4885PTGER3 2745/4885PTGDR 1340/4885

“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.