SCHEMBL3857585

SCHEMBL3857585

CCCCCCCCC(=O)OC(=O)C(CCC)CCCCCCC

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DGKA P23743 1/20 0.52
LMNA P02545 4/20 0.49
MAPT P10636 2/20 0.49
ALDH1A1 P00352 1/20 0.47
PAM P19021 2/20 0.47
KDM4E B2RXH2 1/20 0.46
DUSP3 P51452 1/20 0.46
MEN1 O00255 1/20 0.46
KMT2A Q03164 1/20 0.46
MAPK1 P28482 1/20 0.46
TSHR P16473 2/20 0.45
CA2 P00918 1/20 0.44
PRKCA P17252 1/20 0.44
PRKCE Q02156 1/20 0.44
PRKCQ Q04759 1/20 0.44
PRKCD Q05655 1/20 0.44
DNM1 Q05193 1/20 0.44
CYP3A4 P08684 1/20 0.44
ATM Q13315 1/20 0.44
TDP1 Q9NUW8 1/20 0.44

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
SCHEMBL28941823 1.00 DGKA (0.52) DGKALMNAMAPTALDH1A1PAM
SCHEMBL4849680 0.96 DGKA (0.55) DGKALMNAMAPTALDH1A1PAM
SCHEMBL20394156 0.96 DGKA (0.55) DGKALMNAMAPTALDH1A1PAM
SCHEMBL3075652 0.96 DGKA (0.55) DGKALMNAMAPTALDH1A1PAM
SCHEMBL20394158 0.96 DGKA (0.55) DGKALMNAMAPTALDH1A1PAM
SCHEMBL20394142 0.96 DGKA (0.55) DGKALMNAMAPTALDH1A1PAM
SCHEMBL932347 0.96 DGKA (0.55) DGKALMNAMAPTALDH1A1PAM
SCHEMBL20394140 0.96 DGKA (0.55) DGKALMNAMAPTALDH1A1PAM
SCHEMBL21409708 0.96 DGKA (0.55) DGKALMNAMAPTALDH1A1PAM
SCHEMBL20394164 0.96 DGKA (0.55) DGKALMNAMAPTALDH1A1PAM

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7582678-B2 Use of branched-chain fatty acids and derivatives thereof for the treatment of pain D-PHARM LIMITED (IL) 2009-09-01 US disclosed
EP-1419129-B1 USE OF BRANCHED-CHAIN FATTY ACIDS AND DERIVATIVES THEREOF FOR THE TREATMENT OF PAIN DPHARM LTD (IL) 2008-12-03 EP disclosed
EP-1419129-A4 USE OF BRANCHED-CHAIN FATTY ACIDS AND DERIVATIVES THEREOF FOR THE TREATMENT OF PAIN DPHARM LTD (IL) 2006-05-10 EP disclosed
US-20040235949-A1 Use of branched-chain fatty acids and derivatives thereof for the treatment of pain D-PHARM LIMITED (IL) 2004-11-25 US disclosed
EP-1419129-A2 USE OF BRANCHED-CHAIN FATTY ACIDS AND DERIVATIVES THEREOF FOR THE TREATMENT OF PAIN D-Pharm Limited (IL) 2004-05-19 EP disclosed
US-6518311-B2 Analgesics D-PHARM LTD. (IL) 2003-02-11 US disclosed
WO-2003000173-A2 USE OF BRANCHED-CHAIN FATTY ACIDS AND DERIVATIVES THEREOF FOR THE TREATMENT OF PAIN D-PHARM LIMITED (IL) 2003-01-03 WO disclosed
US-20020042445-A1 Use of branched-chain fatty acids and derivatives thereof for the treatment of pain D-PHARM LTD. (IL) 2002-04-11 US disclosed
US-6251946-B1 SATURATED OR UNSATURATED BRANCHED FATTY ACID CONTAINING LIPID ESTER OR FATTY ACID AMIDE TO TREAT CENTRAL NERVOUS SYSTEM DISORDERS, INCLUDING EPILEPSY, MIGRAINES, CHRONIC PAIN AND BIPOLAR DISORDERS D-PHARM LTD. (IL) 2001-06-26 US disclosed
EP-1009734-A1 BRANCHED CHAIN FATTY ACIDS, THEIR DERIVATIVES AND USE IN THE TREATMENT OF CENTRAL NERVOUS SYSTEM DISORDERS D-PHARM, LTD. (IL) 2000-06-21 EP disclosed
WO-1999002485-A1 BRANCHED CHAIN FATTY ACIDS, THEIR DERIVATIVES AND USE IN THE TREATMENT OF CENTRAL NERVOUS SYSTEM DISORDERS D-PHARM LTD. (IL) 1999-01-21 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-20040235949-A1 Use of branched-chain fatty acids and derivatives thereof for the treatment of pain OPRL1, ELOVL5, ELOVL1 DGKA 911/4885LMNA 2336/4885MAPT 2879/4885
US-20020042445-A1 Use of branched-chain fatty acids and derivatives thereof for the treatment of pain OPRL1, ELOVL5, ELOVL1 DGKA 911/4885LMNA 2336/4885MAPT 2879/4885

“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.