SCHEMBL7644247

SCHEMBL7644247

CCOC(=O)C(=O)CCCCOc1cccc(C)c1

nearest known ligand 0.72

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 4/20 0.58
TDP1 Q9NUW8 2/20 0.58
KMT2A Q03164 3/20 0.53
SMN1; SMN2 Q16637 1/20 0.53
HPGD P15428 2/20 0.50
MAPT P10636 2/20 0.49
MAPK1 P28482 4/20 0.49
LMNA P02545 2/20 0.49
GAA P10253 1/20 0.49
KDM4E B2RXH2 1/20 0.49
MEN1 O00255 2/20 0.48
POLB P06746 2/20 0.48
ALDH1A1 P00352 2/20 0.47
NPC1 O15118 1/20 0.47
RAB9A P51151 1/20 0.47
TSHR P16473 1/20 0.47
HTT P42858 1/20 0.47
NPSR1 Q6W5P4 1/20 0.47
HSD17B10 Q99714 1/20 0.47

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
SCHEMBL12826787 0.89 PLA2G4B (0.52) L3MBTL1TDP1KMT2AMAPK1ALDH1A1
SCHEMBL7637129 0.87 HDAC3 (0.59) L3MBTL1KMT2ASMN1; SMN2HPGDMAPT
SCHEMBL7640248 0.86 KDM4E (0.56) L3MBTL1TDP1KMT2ASMN1; SMN2HPGD
SCHEMBL7635967 0.85 HDAC1 (0.59) TDP1SMN1; SMN2MAPTMAPK1LMNA
SCHEMBL7636030 0.84 L3MBTL1 (0.53) L3MBTL1TDP1KMT2ASMN1; SMN2HPGD
SCHEMBL12745951 0.84 HDAC1 (0.62) TDP1SMN1; SMN2MAPTMAPK1LMNA
SCHEMBL1171581 0.84 HDAC1 (0.62) TDP1SMN1; SMN2MAPTMAPK1LMNA
SCHEMBL7637034 0.84 HDAC1 (0.62) TDP1SMN1; SMN2MAPTMAPK1LMNA
SCHEMBL7644176 0.84 SMN1; SMN2 (0.57) L3MBTL1TDP1KMT2ASMN1; SMN2HPGD
SCHEMBL13590542 0.83 NR4A2 (0.52) L3MBTL1MAPK1ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20110071178-A1 Methods and Compounds for Modulating Cannabinoid Activity NORTHEASTERN UNIVERSITY (US) 2011-03-24 US disclosed
US-20110039874-A1 MONOACYLGLYCEROL LIPASE INHIBITORS FOR MODULATION OF CANNABINOID ACTIVITY NORTHEASTERN UNIVERSITY (US) 2011-02-17 US disclosed
US-6348617-B1 REACTING PYRUVIC ACID COMPOUND IN WATER WITH AMMONIUM OR ALKALI METAL BISULFITE TO GIVE AQUEOUS SOLUTION OF BISULFITE ADDUCT, ISOLATING BY PHASE SEPARATION, OPTIONALLY USING HYDROPHOBIC SOLVENT, CONTACTING WITH ACID TO DECOMPOSE ADDUCT SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2002-02-19 US disclosed
EP-0937703-A1 METHOD FOR PURIFYING PYRUVIC ACID COMPOUNDS SUMITOMO CHEMICAL COMPANY LIMITED (JP) 1999-08-25 EP 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-20110039874-A1 MONOACYLGLYCEROL LIPASE INHIBITORS FOR MODULATION OF CANNABINOID ACTIVITY MGLL, FAAH, FAAH2 L3MBTL1 2499/4885TDP1 2638/4885KMT2A 1984/4885
US-20110071178-A1 Methods and Compounds for Modulating Cannabinoid Activity FAAH, FAAH2, CNR2 L3MBTL1 4154/4885TDP1 3167/4885KMT2A 2153/4885

“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.