SCHEMBL2217009

SCHEMBL2217009

CCCCCC=CCC=CCC=CCC=CCCCC(=O)OCCCC/C=C\C/C=C\C/C=C\C/C=C\CCCCC

nearest known ligand 0.82

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MGLL Q99685 1/20 0.82
ALDH1A1 P00352 3/20 0.80
MAPT P10636 3/20 0.80
CNR1 P21554 3/20 0.80
THRB P10828 1/20 0.80
FAAH O00519 3/20 0.65
PPARG P37231 2/20 0.62
HPGD P15428 2/20 0.62
KDM4E B2RXH2 1/20 0.62
MEN1 O00255 1/20 0.62
USP2 O75604 1/20 0.62
LMNA P02545 1/20 0.62
TP53 P04637 1/20 0.62
CYP3A4 P08684 1/20 0.62
HSPD1 P10809 1/20 0.62
CYP19A1 P11511 1/20 0.62
FABP4 P15090 1/20 0.62
ALOX15 P16050 1/20 0.62
CASP1 P29466 1/20 0.62
NR4A2 P43354 1/20 0.62

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
SCHEMBL3656524 1.00 MGLL (0.82) MGLLALDH1A1MAPTCNR1THRB
SCHEMBL3656522 1.00 MGLL (0.82) MGLLALDH1A1MAPTCNR1THRB
SCHEMBL25290964 0.98 MGLL (0.80) MGLLALDH1A1MAPTCNR1THRB
SCHEMBL25286022 0.98 MGLL (0.80) MGLLALDH1A1MAPTCNR1THRB
SCHEMBL25293178 0.98 MGLL (0.80) MGLLALDH1A1MAPTCNR1THRB
SCHEMBL25246353 0.98 MGLL (0.80) MGLLALDH1A1MAPTCNR1THRB
SCHEMBL25290861 0.98 MGLL (0.80) MGLLALDH1A1MAPTCNR1THRB
SCHEMBL25293628 0.98 MGLL (0.80) MGLLALDH1A1MAPTCNR1THRB
SCHEMBL25292755 0.98 MGLL (0.80) MGLLALDH1A1MAPTCNR1THRB
SCHEMBL23779987 0.98 MGLL (0.80) MGLLALDH1A1MAPTCNR1THRB

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
US-20140309273-A1 COMPOUNDS AND METHODS OF TREATING OBESITY YISSUM RESEARCH DEVELOPMENT COMPANY OF THE HEBREW UNIVERSITY OF JERUSALEM LTD. (IL) 2014-10-16 US claimed
US-20110178151-A1 COMPOUNDS AND METHODS OF TREATING OBESITY YISSUM RESEARCH DEVELOPMENT COMPANY OF THE HEBREW (IL) 2011-07-21 US claimed
EP-2262763-A2 COMPOUNDS AND METHODS OF TREATING OBESITY Yissum Research Development Company of the Hebrew University of Jerusalem Ltd. (IL) 2010-12-22 EP claimed
WO-2009109973-A2 COMPOUNDS AND METHODS OF TREATING OBESITY YISSUM RESEARCH DEVELOPMENT COMPANY OF THE HEBREW UNIVERSITY OF JERUSALEM LTD. (IL) 2009-09-11 WO claimed
US-9428448-B2 Compounds and methods of treating obesity YISSUM RESEARCH DEVELOPMENT COMPANY OF THE HEBREW UNIVERSITY OF JERUSALEM LTD. (IL) 2016-08-30 US disclosed
US-20140309273-A1 COMPOUNDS AND METHODS OF TREATING OBESITY YISSUM RESEARCH DEVELOPMENT COMPANY OF THE HEBREW UNIVERSITY OF JERUSALEM LTD. (IL) 2014-10-16 US disclosed
US-20110178151-A1 COMPOUNDS AND METHODS OF TREATING OBESITY YISSUM RESEARCH DEVELOPMENT COMPANY OF THE HEBREW (IL) 2011-07-21 US disclosed
EP-2262763-A2 COMPOUNDS AND METHODS OF TREATING OBESITY Yissum Research Development Company of the Hebrew University of Jerusalem Ltd. (IL) 2010-12-22 EP disclosed
WO-2009109973-A2 COMPOUNDS AND METHODS OF TREATING OBESITY YISSUM RESEARCH DEVELOPMENT COMPANY OF THE HEBREW UNIVERSITY OF JERUSALEM LTD. (IL) 2009-09-11 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-20140309273-A1 COMPOUNDS AND METHODS OF TREATING OBESITY FABP4, LIPC, GPR119 MGLL 61/4885ALDH1A1 939/4885MAPT 1065/4885
US-20110178151-A1 COMPOUNDS AND METHODS OF TREATING OBESITY GPR119, FABP4, LIPC MGLL 65/4885ALDH1A1 933/4885MAPT 1149/4885

“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.