SCHEMBL1634167

SCHEMBL1634167

CCC(CCCC(=O)O)c1cccc(OCc2c(C)cccc2C)c1

nearest known ligand 0.48

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
CYSLTR2 Q9NS75 5/20 0.48
CYSLTR1 Q9Y271 5/20 0.48
SLC22A12 Q96S37 1/20 0.42
KMT2A Q03164 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
FFAR1 O14842 2/20 0.41
NR1H4 Q96RI1 1/20 0.40

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
SCHEMBL1634518 0.85 FFAR1 (0.51) SLC22A12KMT2ASMN1; SMN2FFAR1
SCHEMBL1634164 0.84 CYSLTR2 (0.59) CYSLTR2CYSLTR1SLC22A12KMT2ASMN1; SMN2
SCHEMBL1634801 0.83 CYSLTR2 (0.58) CYSLTR2CYSLTR1SLC22A12KMT2ASMN1; SMN2
SCHEMBL1007881 0.82 SLC22A12 (0.44) CYSLTR2CYSLTR1SLC22A12KMT2ASMN1; SMN2
SCHEMBL957166 0.82 SLC22A12 (0.44) CYSLTR2CYSLTR1SLC22A12KMT2ASMN1; SMN2
SCHEMBL956150 0.79 AKR1C3 (0.46) SLC22A12KMT2ASMN1; SMN2FFAR1
SCHEMBL2745435 0.79 AKR1C3 (0.46) SLC22A12KMT2ASMN1; SMN2FFAR1
SCHEMBL954242 0.77 FFAR1 (0.54) CYSLTR2CYSLTR1SLC22A12SMN1; SMN2FFAR1
SCHEMBL954605 0.76 PTGS1 (0.58) SLC22A12KMT2ASMN1; SMN2FFAR1
SCHEMBL2745203 0.76 PTGS1 (0.58) SLC22A12KMT2ASMN1; SMN2FFAR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7932290-B2 Method for the treatment of metabolic disorders WELLSTAT BIOLOGICS CORPORATION (US) 2011-04-26 US disclosed
EP-2266946-A2 Compound For The Treatment Of Metabolic Disorders Wellstat Therapeutics Corporation (US) 2010-12-29 EP disclosed
US-20100087541-A1 COMPOUNDS FOR THE TREATMENT OF METABOLIC DISORDERS WELLSTAT THERAPEUTICS CORPORATION (US) 2010-04-08 US disclosed
US-7615575-B2 Compounds for the treatment of metabolic disorders WELLSTAT THERAPEUTICS CORPORATION (US) 2009-11-10 US disclosed
US-7605181-B2 Method for the treatment of metabolic disorders Wellstat Therapeutics Orporation (US) 2009-10-20 US disclosed
US-20080015254-A1 COMPOUNDS FOR THE TREATMENT OF METABOLIC DISORDERS WELLSTAT THERAPEUTICS CORPORATION (US) 2008-01-17 US disclosed
EP-1601251-A4 COMPOUNDS FOR THE TREATMENT OF METABOLIC DISORDERS WELLSTAT THERAPEUTICS CORP (US) 2007-03-28 EP disclosed
US-20060247309-A1 Compounds for the treatment of metabolic disorders PHARMA CINQ, LLC 2006-11-02 US disclosed
EP-1601251-A2 COMPOUNDS FOR THE TREATMENT OF METABOLIC DISORDERS Wellstat Therapeutics Corporation (US) 2005-12-07 EP disclosed
WO-2004073611-A2 COMPOUNDS FOR THE TREATMENT OF METABOLIC DISORDERS WELLSTAT THERAPEUTICS CORPORATION (US) 2004-09-02 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 (3 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-20100087541-A1 COMPOUNDS FOR THE TREATMENT OF METABOLIC DISORDERS CPT1B, FABP1, CPT1A CYSLTR2 4450/4885CYSLTR1 3664/4885SLC22A12 1447/4885
US-20080015254-A1 COMPOUNDS FOR THE TREATMENT OF METABOLIC DISORDERS CPT1B, FABP1, CPT1A CYSLTR2 4450/4885CYSLTR1 3664/4885SLC22A12 1447/4885
US-20060247309-A1 Compounds for the treatment of metabolic disorders CPT1B, CPT1A, FABP1 CYSLTR2 3492/4885CYSLTR1 2797/4885SLC22A12 908/4885

“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.