SCHEMBL469579

SCHEMBL469579

CCCCC/C=C/C/C=C/CCCCCCCC(=O)Nc1cccc(CC(=O)O)c1

nearest known ligand 0.68

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ SOAT2 O75908 1/20 0.68
▸ SOAT1 P35610 1/20 0.68
▸ EPHX2 P34913 5/20 0.60
▸ CNR1 P21554 5/20 0.60
▸ FAAH O00519 4/20 0.60
▸ CNR2 P34972 4/20 0.60
▸ PSMB11 A5LHX3 2/20 0.57
▸ PSMA7 O14818 2/20 0.57
▸ PSMB1 P20618 2/20 0.57
▸ PSMA1 P25786 2/20 0.57
▸ PSMA2 P25787 2/20 0.57
▸ PSMA3 P25788 2/20 0.57
▸ PSMA4 P25789 2/20 0.57
▸ PSMB8 P28062 2/20 0.57
▸ PSMB9 P28065 2/20 0.57
▸ PSMA5 P28066 2/20 0.57
▸ PSMB4 P28070 2/20 0.57
▸ PSMB6 P28072 2/20 0.57
▸ PSMB5 P28074 2/20 0.57
▸ PSMB10 P40306 2/20 0.57

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
SCHEMBL469464 0.99 SOAT2 (0.66) SOAT2SOAT1EPHX2CNR1FAAH
SCHEMBL469516 0.98 SOAT2 (0.71) SOAT2SOAT1EPHX2CNR1FAAH
SCHEMBL10077351 0.97 SOAT2 (0.62) SOAT2SOAT1EPHX2CNR1FAAH
SCHEMBL469656 0.89 EPHX2 (0.58) SOAT2SOAT1EPHX2CNR1FAAH
SCHEMBL18240159 0.84 SOAT2 (0.94) SOAT2SOAT1EPHX2CNR1FAAH
SCHEMBL10077432 0.84 SELP (0.55) SOAT2SOAT1EPHX2CNR1FAAH
SCHEMBL469507 0.84 SELP (0.55) SOAT2SOAT1EPHX2CNR1FAAH
SCHEMBL454877 0.84 SELP (0.55) SOAT2SOAT1EPHX2CNR1FAAH
SCHEMBL9206018 0.83 SOAT2 (0.69) SOAT2SOAT1EPHX2CNR1FAAH
SCHEMBL29379899 0.82 SOAT2 (1.00) SOAT2SOAT1EPHX2CNR1FAAH

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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
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

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 371/4885EPHX2 99/4885
US-20160120995-A1 CONJUGATES OF POLYUNSATURATED FATTY ACIDS AND AMINE-CONTAINING COMPOUNDS AND USES THEREOF ALOX5, ALOX15B, ALOX15 SOAT2 151/4885SOAT1 364/4885EPHX2 91/4885

“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.

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