SCHEMBL3976053

SCHEMBL3976053

Cc1ccc(SCCCC(=O)O)c(Oc2ccc3oc4ccccc4c3c2)c1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.48
ACSL1 P33121 2/20 0.47
ACSL6 Q9UKU0 2/20 0.47
PTGER4 P35408 1/20 0.43
KDM4E B2RXH2 3/20 0.42
HPGD P15428 3/20 0.42
GPR55 Q9Y2T6 2/20 0.42
NPSR1 Q6W5P4 2/20 0.41
RXFP1 Q9HBX9 1/20 0.41
PTGS2 P35354 4/20 0.41
MAPT P10636 5/20 0.41
ALDH1A1 P00352 4/20 0.40
NPC1 O15118 2/20 0.40
RAB9A P51151 2/20 0.40
MEN1 O00255 1/20 0.40
KMT2A Q03164 1/20 0.40
POLB P06746 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.39
GAA P10253 1/20 0.39

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
SCHEMBL3969195 0.77 TSHR (0.43) LMNAHPGDPTGS2MAPTALDH1A1
SCHEMBL3971634 0.77 PTGS2 (0.45) PTGS2ALDH1A1L3MBTL1GAA
SCHEMBL3971665 0.73 PTPN1 (0.45) LMNAPTGER4KDM4EHPGDNPSR1
SCHEMBL7812629 0.73 ACSL1 (0.77) LMNAACSL1ACSL6PTGER4NPSR1
SCHEMBL26717425 0.69 PTGS2 (0.54) KDM4ENPSR1PTGS2MAPTALDH1A1
SCHEMBL8164337 0.67 TSHR (0.57) HPGDPTGS2ALDH1A1L3MBTL1SMN1; SMN2
SCHEMBL11993095 0.67 LMNA (0.47) LMNAPTGER4KDM4EHPGDNPSR1
SCHEMBL20322862 0.67 LMNA (1.00) LMNAACSL1ACSL6PTGER4KDM4E
SCHEMBL4276529 0.66 TSHR (0.54) LMNAKDM4EHPGDPTGS2MAPT
SCHEMBL3976050 0.66 LMNA (0.46) LMNAACSL1ACSL6PTGER4KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7491747-B2 4-(Arylthio)- or (4-heteroarylthio)butyric acid derivatives that may be used in the treatment of dyslipidaemia, atherosclerosis and diabetes MERCK PATENT GMBH (DE) 2009-02-17 US disclosed
US-20050020651-A1 Butyric acid derivatives MERCK PATENT GMBH (DE) 2005-01-27 US 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-20050020651-A1 Butyric acid derivatives GPR119, DBI, GABRB1 LMNA 743/4885ACSL1 33/4885ACSL6 128/4885

“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.