SCHEMBL14975252

SCHEMBL14975252

O=C(O)n1cccc(Cc2cccc(-c3ccccc3)c2)c1=O

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ LIPG Q9Y5X9 1/20 0.44
▸ IDH1 O75874 1/20 0.44
▸ ACMSD Q8TDX5 1/20 0.42
▸ FAAH O00519 2/20 0.40
▸ NAAA Q02083 1/20 0.40
▸ AOC3 Q16853 3/20 0.40
▸ PTPN1 P18031 1/20 0.40
▸ PTPN5 P54829 2/20 0.39
▸ MPO P05164 1/20 0.39
▸ BCL2 P10415 1/20 0.38
▸ HDAC1 Q13547 1/20 0.38
▸ PTGS2 P35354 1/20 0.38
▸ MMP1 P03956 1/20 0.38
▸ MMP2 P08253 1/20 0.38
▸ MMP12 P39900 1/20 0.38
▸ PTGER1 P34995 1/20 0.38
▸ PTGER4 P35408 1/20 0.38
▸ PTGER3 P43115 1/20 0.38
▸ PTGER2 P43116 1/20 0.38
▸ NR4A2 P43354 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
SCHEMBL14975268 0.87 TSHR (0.42) FAAHNAAAPTPN1MMP2MMP12
SCHEMBL14975293 0.77 FFAR1 (0.46) NAAAHDAC1MMP2MMP12
SCHEMBL16058386 0.77 HPGD (0.40) IDH1PTGS2PTGER3
SCHEMBL14975640 0.76 NR1H2 (0.44) IDH1HDAC1
SCHEMBL17557049 0.75 POLB (0.44) IDH1
SCHEMBL16057165 0.75 ALDH1A1 (0.48) FAAH
SCHEMBL16058352 0.74 BID (0.50) FAAHNAAAHDAC1
SCHEMBL14975362 0.74 BID (0.50) FAAHNAAAHDAC1
SCHEMBL14975000 0.74 BID (0.50) FAAHNAAAHDAC1
SCHEMBL14975444 0.74 BID (0.50) FAAHNAAAHDAC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2782567-B1 DISUBSTITUTED BETA-LACTONES AS INHIBITORS OF N-ACYLETHANOLAMINE ACID AMIDASE (NAAA) UNIV CALIFORNIA (US) 2017-03-22 — — EP disclosed
US-20160235707-A1 DISUBSTITUTED BETA-LACTONES AS INHIBITORS OF N-ACYLETHANOLAMINE ACID AMIDASE (NAAA) FOND ST ITALIANO TECNOLOGIA (IT) 2016-08-18 — — US disclosed
US-9353075-B2 Disubstituted beta-lactones as inhibitors of N-acylethanolamine acid amidase (NAAA) THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2016-05-31 — — US disclosed
EP-2782567-A1 DISUBSTITUTED BETA-LACTONES AS INHIBITORS OF N-ACYLETHANOLAMINE ACID AMIDASE (NAAA) The Regents of The University of California (US) 2014-10-01 — — EP disclosed
US-20130281490-A1 Disubstituted Beta-lactones as Inhibitors of N-Acylethanolamine Acid Amidase (NAAA) THE REGENTS OF THE UNIVERSITY OF CALIFORNIA 2013-10-24 — — US disclosed
WO-2013078430-A1 DISUBSTITUTED BETA-LACTONES AS INHIBITORS OF N-ACYLETHANOLAMINE ACID AMIDASE (NAAA) THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2013-05-30 — — 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-20130281490-A1 Disubstituted Beta-lactones as Inhibitors of N-Acylethanolamine Acid Amidase (NAAA) NAAA, FAAH, FAAH2 LIPG 85/4885IDH1 2817/4885ACMSD 524/4885
US-20160235707-A1 DISUBSTITUTED BETA-LACTONES AS INHIBITORS OF N-ACYLETHANOLAMINE ACID AMIDASE (NAAA) NAAA, FAAH, FAAH2 LIPG 85/4885IDH1 2817/4885ACMSD 524/4885

“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.

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