SCHEMBL2184062

SCHEMBL2184062

CCCCC/C=C\C/C=C\C/C=C\C/C=C\CCCC(=O)Oc1cc2oc(=O)cc(C)c2cc1OC

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 4/20 0.49
▸ KDM4E B2RXH2 4/20 0.49
▸ GLA P06280 3/20 0.49
▸ GAA P10253 3/20 0.49
▸ SMN1; SMN2 Q16637 2/20 0.49
▸ MAPT P10636 2/20 0.49
▸ HPGD P15428 2/20 0.49
▸ HSP90AA1 P07900 1/20 0.49
▸ HSP90AB1 P08238 1/20 0.49
▸ ALPG P10696 1/20 0.49
▸ ALOX15 P16050 1/20 0.49
▸ ALOX12 P18054 1/20 0.49
▸ CASP1 P29466 1/20 0.49
▸ CASP7 P55210 1/20 0.49
▸ HSD17B10 Q99714 1/20 0.49
▸ KMT2A Q03164 1/20 0.47
▸ FPR1 P21462 1/20 0.43
▸ ELANE P08246 1/20 0.43
▸ CNR1 P21554 4/20 0.42
▸ CNR2 P34972 4/20 0.42

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
SCHEMBL2184064 1.00 ALDH1A1 (0.49) ALDH1A1KDM4EGLAGAASMN1; SMN2
SCHEMBL8527989 0.93 ALDH1A1 (0.52) ALDH1A1KDM4EGLAGAASMN1; SMN2
SCHEMBL6265896 0.84 KDM4E (0.61) ALDH1A1KDM4EGLAGAASMN1; SMN2
SCHEMBL6267523 0.84 KDM4E (0.61) ALDH1A1KDM4EGLAGAASMN1; SMN2
SCHEMBL6264833 0.84 KDM4E (0.61) ALDH1A1KDM4EGLAGAASMN1; SMN2
SCHEMBL6265537 0.84 KDM4E (0.61) ALDH1A1KDM4EGLAGAASMN1; SMN2
SCHEMBL12414751 0.83 CNR1 (0.44) ALDH1A1KDM4EGLAGAASMN1; SMN2
SCHEMBL8526039 0.78 KDM4E (0.53) ALDH1A1KDM4EGLAGAASMN1; SMN2
SCHEMBL13171966 0.77 ALDH1A1 (0.73) ALDH1A1KDM4EGLAGAASMN1; SMN2
SCHEMBL1095445 0.77 ALDH1A1 (0.73) ALDH1A1KDM4EGLAGAASMN1; SMN2

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
US-20160139162-A1 Inhibitors Of Fatty Acid Amide Hydrolase And Monoacylglycerol Lipase For Modulation Of Cannabinoid Receptors NORTHEASTERN UNIVERSITY 2016-05-19 — — US disclosed
US-20160139162-A1 Inhibitors Of Fatty Acid Amide Hydrolase And Monoacylglycerol Lipase For Modulation Of Cannabinoid Receptors NORTHEASTERN UNIVERSITY 2016-05-19 — — US disclosed
US-20160139162-A1 Inhibitors Of Fatty Acid Amide Hydrolase And Monoacylglycerol Lipase For Modulation Of Cannabinoid Receptors NORTHEASTERN UNIVERSITY 2016-05-19 — — US disclosed
US-9271962-B2 Inhibitors of fatty acid amide hydrolase and monoacylglycerol lipase for modulation of cannabinoid receptors NORTHEASTERN UNIVERSITY (US) 2016-03-01 — — US disclosed
US-20110166138-A1 Inhibitors of Fatty Acid Amide Hydrolase and Monoacylglycerol Lipase for Modulation of Cannabinoid Receptors NATIONAL INSTITUTES OF HEALTH - DIRECTOR DEITR 2011-07-07 — — US disclosed
WO-2009117444-A1 INHIBITORS OF FATTY ACID AMIDE HYDROLASE AND MONOACYLGLYCEROL LIPASE FOR MODULATION OF CANNABINOID RECEPTORS NORTHEASTERN UNIVERSITY (US) 2009-09-24 — — 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 (1 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-20110166138-A1 Inhibitors of Fatty Acid Amide Hydrolase and Monoacylglycerol Lipase for Modulation of Cannabinoid Receptors FAAH, FAAH2, MGLL ALDH1A1 1388/4885KDM4E 2289/4885GLA 870/4885

“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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