SCHEMBL17706000

SCHEMBL17706000

O=C(O)CCC(NC(=O)NC(CCCCNC(=O)C(Cc1ccc2ccccc2c1)NC(=O)C1CCC(CNC(=O)CF)CC1)C(=O)O)C(=O)O

nearest known ligand 0.81

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ FOLH1 Q04609 19/20 0.81
▸ PLG P00747 1/20 0.51
▸ PRSS1 P07477 1/20 0.51
▸ PRSS2 P07478 1/20 0.51
▸ PRSS3 P35030 1/20 0.51

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
SCHEMBL31635857 0.94 FOLH1 (0.82) FOLH1PLGPRSS1PRSS2PRSS3
SCHEMBL21310703 0.94 FOLH1 (0.82) FOLH1PLGPRSS1PRSS2PRSS3
SCHEMBL22883225 0.94 FOLH1 (0.82) FOLH1PLGPRSS1PRSS2PRSS3
SCHEMBL24374933 0.93 FOLH1 (0.81) FOLH1PLGPRSS1PRSS2PRSS3
SCHEMBL19296398 0.93 FOLH1 (0.77) FOLH1PLGPRSS1PRSS2PRSS3
SCHEMBL21310479 0.92 FOLH1 (0.80) FOLH1PLGPRSS1PRSS2PRSS3
SCHEMBL19296397 0.92 FOLH1 (0.76) FOLH1PLGPRSS1PRSS2PRSS3
SCHEMBL22883382 0.92 FOLH1 (0.79) FOLH1PLGPRSS1PRSS2PRSS3
SCHEMBL22883383 0.92 FOLH1 (0.79) FOLH1PLGPRSS1PRSS2PRSS3
SCHEMBL29679267 0.91 FOLH1 (0.79) FOLH1PLGPRSS1PRSS2PRSS3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10016519-B2 18F-tagged inhibitors of prostate specific membrane antigen (PSMA), their use as imaging agents and pharmaceutical agents for the treatment of prostate cancer DEUTSCHES KREBSFORSCHUNGSZENTRIUM (DE) 2018-07-10 — — US disclosed
US-20170246327-A1 18F-TAGGED INHIBITORS OF PROSTATE SPECIFIC MEMBRANE ANTIGEN (PSMA), THEIR USE AS IMAGING AGENTS AND PHARMACEUTICAL AGENTS FOR THE TREATMENT OF PROSTATE CANCER Ruprecht-Karls-Universität Heidelberg (DE) 2017-08-31 — — US disclosed
US-20170246327-A1 18F-TAGGED INHIBITORS OF PROSTATE SPECIFIC MEMBRANE ANTIGEN (PSMA), THEIR USE AS IMAGING AGENTS AND PHARMACEUTICAL AGENTS FOR THE TREATMENT OF PROSTATE CANCER Ruprecht-Karls-Universität Heidelberg (DE) 2017-08-31 — — US disclosed
EP-3011976-A1 18F-tagged inhibitors of prostate specific membrane antigen (PSMA), their use as imaging agents Deutsches Krebsforschungszentrum (DE) 2016-04-27 — — EP 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-10016519-B2 18F-tagged inhibitors of prostate specific membrane antigen (PSMA), their use as imaging agents and pharmaceutical agents for the treatment of prostate cancer KLK3, FOLH1, PSMA6 FOLH1 2/4885PLG 1888/4885PRSS1 827/4885
US-20170246327-A1 18F-TAGGED INHIBITORS OF PROSTATE SPECIFIC MEMBRANE ANTIGEN (PSMA), THEIR USE AS IMAGING AGENTS AND PHARMACEUTICAL AGENTS FOR THE TREATMENT OF PROSTATE CANCER KLK3, FOLH1, PSMA6 FOLH1 2/4885PLG 1888/4885PRSS1 827/4885

“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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