SCHEMBL454376

SCHEMBL454376

CCCCCCCC/C=C\CCCCCCCC(=O)Nc1ncccc1C(=O)O

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SOAT2 O75908 1/20 0.62
SOAT1 P35610 1/20 0.62
PSMB11 A5LHX3 1/20 0.54
PSMA7 O14818 1/20 0.54
PSMB1 P20618 1/20 0.54
PSMA1 P25786 1/20 0.54
PSMA2 P25787 1/20 0.54
PSMA3 P25788 1/20 0.54
PSMA4 P25789 1/20 0.54
PSMB8 P28062 1/20 0.54
PSMB9 P28065 1/20 0.54
PSMA5 P28066 1/20 0.54
PSMB4 P28070 1/20 0.54
PSMB6 P28072 1/20 0.54
PSMB5 P28074 1/20 0.54
PSMB10 P40306 1/20 0.54
PSMB3 P49720 1/20 0.54
PSMB2 P49721 1/20 0.54
PSMA6 P60900 1/20 0.54
PSMA8 Q8TAA3 1/20 0.54

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
SCHEMBL23566412 0.98 SOAT2 (0.59) SOAT2SOAT1PSMB11PSMA7PSMB1
SCHEMBL18640833 0.98 SOAT2 (0.59) SOAT2SOAT1PSMB11PSMA7PSMB1
SCHEMBL18640734 0.93 LMNA (0.56) SOAT2SOAT1EPHX2LMNAPOLB
SCHEMBL18640835 0.93 LMNA (0.56) SOAT2SOAT1EPHX2LMNAPOLB
SCHEMBL10604660 0.83 SOAT2 (0.67) SOAT2SOAT1PSMB11PSMA7PSMB1
SCHEMBL9223960 0.81 SOAT1 (0.70) SOAT2SOAT1PSMB11PSMA7PSMB1
SCHEMBL9223956 0.81 SOAT1 (0.70) SOAT2SOAT1PSMB11PSMA7PSMB1
SCHEMBL30932627 0.81 HPGD (0.60) LMNAPOLBMEN1KMT2A
SCHEMBL8993787 0.81 SOAT2 (0.64) SOAT2SOAT1PSMB11PSMA7PSMB1
SCHEMBL469583 0.81 ALDH1A1 (0.47) FAAHEPHX2CNR1CNR2LMNA

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
EP-2613779-A2 CONJUGATES OF POLYUNSATURATED FATTY ACIDS AND AMINE-CONTAINING COMPOUNDS AND USES THEREOF Medwell Laboratories Ltd. (IL) 2013-07-17 EP claimed
US-20130158070-A1 CONJUGATES OF POLYUNSATURATED FATTY ACIDS AND AMINE-CONTAINING COMPOUNDS AND USES THEREOF MEDWELL LABORATORIES LTD. (IL) 2013-06-20 US claimed
WO-2012032509-A2 CONJUGATES OF POLYUNSATURATED FATTY ACIDS AND AMINE-CONTAINING COMPOUNDS AND USES THEREOF MEDWELL LABORATORIES LTD. (IL) 2012-03-15 WO claimed
US-20160120995-A1 CONJUGATES OF POLYUNSATURATED FATTY ACIDS AND AMINE-CONTAINING COMPOUNDS AND USES THEREOF MEDWELL LAB LTD (IL) 2016-05-05 US disclosed
US-20160120995-A1 CONJUGATES OF POLYUNSATURATED FATTY ACIDS AND AMINE-CONTAINING COMPOUNDS AND USES THEREOF MEDWELL LAB LTD (IL) 2016-05-05 US disclosed
EP-2613779-A2 CONJUGATES OF POLYUNSATURATED FATTY ACIDS AND AMINE-CONTAINING COMPOUNDS AND USES THEREOF Medwell Laboratories Ltd. (IL) 2013-07-17 EP disclosed
US-20130158070-A1 CONJUGATES OF POLYUNSATURATED FATTY ACIDS AND AMINE-CONTAINING COMPOUNDS AND USES THEREOF MEDWELL LABORATORIES LTD. (IL) 2013-06-20 US disclosed
US-20130158070-A1 CONJUGATES OF POLYUNSATURATED FATTY ACIDS AND AMINE-CONTAINING COMPOUNDS AND USES THEREOF MEDWELL LABORATORIES LTD. (IL) 2013-06-20 US disclosed
WO-2012032509-A2 CONJUGATES OF POLYUNSATURATED FATTY ACIDS AND AMINE-CONTAINING COMPOUNDS AND USES THEREOF MEDWELL LABORATORIES LTD. (IL) 2012-03-15 WO disclosed
WO-2012032509-A2 CONJUGATES OF POLYUNSATURATED FATTY ACIDS AND AMINE-CONTAINING COMPOUNDS AND USES THEREOF MEDWELL LABORATORIES LTD. (IL) 2012-03-15 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-20130158070-A1 CONJUGATES OF POLYUNSATURATED FATTY ACIDS AND AMINE-CONTAINING COMPOUNDS AND USES THEREOF ALOX5, ALOX15B, ALOX15 SOAT2 148/4885SOAT1 371/4885PSMB11 2836/4885
US-20160120995-A1 CONJUGATES OF POLYUNSATURATED FATTY ACIDS AND AMINE-CONTAINING COMPOUNDS AND USES THEREOF ALOX5, ALOX15B, ALOX15 SOAT2 151/4885SOAT1 364/4885PSMB11 2812/4885

“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.