SCHEMBL17533548

SCHEMBL17533548

CCCOC(=O)CCC(CP(=O)(OCC)OCC)C(=O)OCCC

nearest known ligand 0.40

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
DGKA P23743 1/20 0.34
L3MBTL1 Q9Y468 2/20 0.33
ALDH1A1 P00352 1/20 0.33
MAPT P10636 1/20 0.33
MAPK1 P28482 1/20 0.33
PPARD Q03181 1/20 0.33
TSHR P16473 1/20 0.32
P2RY10 O00398 4/20 0.32
GPR34 Q9UPC5 2/20 0.32
LPAR6 P43657 1/20 0.31
LPAR1 Q92633 1/20 0.31
LPAR4 Q99677 1/20 0.31
LPAR5 Q9H1C0 1/20 0.31
LPAR2 Q9HBW0 1/20 0.31
LPAR3 Q9UBY5 1/20 0.31
ENPP2 Q13822 1/20 0.31

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
SCHEMBL17533538 0.86 L3MBTL1 (0.44) L3MBTL1ALDH1A1MAPTMAPK1PPARD
SCHEMBL17504761 0.83 FOLH1 (0.42) DGKAL3MBTL1ALDH1A1P2RY10GPR34
SCHEMBL21804584 0.81 DGKA (0.49) DGKAP2RY10GPR34LPAR6LPAR1
SCHEMBL17533650 0.81 FOLH1 (0.40) DGKAL3MBTL1ALDH1A1ENPP2
SCHEMBL14199952 0.81 DGKA (0.45) DGKAL3MBTL1ALDH1A1MAPTMAPK1
SCHEMBL17533680 0.79 TSHR (0.43) L3MBTL1ALDH1A1MAPTMAPK1PPARD
SCHEMBL23923374 0.79 HTR2C (0.39) DGKAP2RY10GPR34LPAR6LPAR1
SCHEMBL26424122 0.78 P2RY10 (0.36) DGKAALDH1A1P2RY10GPR34LPAR6
SCHEMBL26424316 0.78 P2RY10 (0.36) DGKAALDH1A1P2RY10GPR34LPAR6
SCHEMBL27812596 0.77 CA2 (0.44) DGKAL3MBTL1ALDH1A1MAPTMAPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11325931-B2 Prodrugs of prostate specific membrane antigen (PSMA) inhibitor THE JOHNS HOPKINS UNIVERSITY (US) 2022-05-10 US disclosed
US-20200399298-A1 PRODRUGS OF PROSTATE SPECIFIC MEMBRANE ANTIGEN (PSMA) INHIBITOR THE JOHNS HOPKINS UNIVERSITY 2020-12-24 US disclosed
US-10544176-B2 Prodrugs of prostate specific membrane antigen (PSMA) inhibitor THE JOHNS HOPKINS UNIVERSITY (US) 2020-01-28 US disclosed
US-9988407-B2 Prodrugs of prostate specific membrane antigen (PSMA) inhibitor THE JOHNS HOPKINS UNIVERSITY (US) 2018-06-05 US disclosed
US-9988407-B2 Prodrugs of prostate specific membrane antigen (PSMA) inhibitor THE JOHNS HOPKINS UNIVERSITY (US) 2018-06-05 US disclosed
US-20170226141-A1 PRODRUGS OF PROSTATE SPECIFIC MEMBRANE ANTIGEN (PSMA) INHIBITOR THE JOHNS HOPKINS UNIVERSITY (US) 2017-08-10 US disclosed
US-20170226141-A1 PRODRUGS OF PROSTATE SPECIFIC MEMBRANE ANTIGEN (PSMA) INHIBITOR THE JOHNS HOPKINS UNIVERSITY (US) 2017-08-10 US disclosed
WO-2016022827-A1 PRODRUGS OF PROSTATE SPECIFIC MEMBRANE ANTIGEN (PSMA) INHIBITOR THE JOHNS HOPKINS UNIVERSITY (US) 2016-02-11 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 (4 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-11325931-B2 Prodrugs of prostate specific membrane antigen (PSMA) inhibitor FOLH1, KLK3, DNPEP DGKA 2974/4885L3MBTL1 3247/4885ALDH1A1 796/4885
US-20170226141-A1 PRODRUGS OF PROSTATE SPECIFIC MEMBRANE ANTIGEN (PSMA) INHIBITOR FOLH1, KLK3, DNPEP DGKA 2974/4885L3MBTL1 3247/4885ALDH1A1 796/4885
US-20200399298-A1 PRODRUGS OF PROSTATE SPECIFIC MEMBRANE ANTIGEN (PSMA) INHIBITOR FOLH1, KLK3, DNPEP DGKA 2773/4885L3MBTL1 3188/4885ALDH1A1 718/4885
US-10544176-B2 Prodrugs of prostate specific membrane antigen (PSMA) inhibitor FOLH1, KLK3, DNPEP DGKA 2974/4885L3MBTL1 3247/4885ALDH1A1 796/4885

“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.