SCHEMBL19475132

SCHEMBL19475132

C[Si](C)(C)CCOCOc1cccc(C(=O)N2CC(=O)C[C@H]2C(=O)O)c1

nearest known ligand 0.42

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ GRM5 P41594 6/20 0.42
▸ CFTR P13569 7/20 0.41
▸ ALDH1A1 P00352 2/20 0.37
▸ KDM4E B2RXH2 1/20 0.37
▸ NAAA Q02083 1/20 0.36
▸ L3MBTL1 Q9Y468 1/20 0.35
▸ KMT2A Q03164 1/20 0.35

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
SCHEMBL20996808 1.00 GRM5 (0.42) GRM5CFTRALDH1A1KDM4ENAAA
SCHEMBL19505918 0.91 CFTR (0.40) GRM5CFTRALDH1A1KDM4EKMT2A
SCHEMBL19475038 0.89 L3MBTL1 (0.45) GRM5ALDH1A1L3MBTL1KMT2A
SCHEMBL20996813 0.83 POLB (0.32) GRM5L3MBTL1
SCHEMBL19475321 0.83 POLB (0.32) GRM5L3MBTL1
SCHEMBL19475167 0.80 ALDH1A1 (0.39) GRM5ALDH1A1NAAAL3MBTL1KMT2A
SCHEMBL19475165 0.80 ALDH1A1 (0.39) GRM5ALDH1A1NAAAL3MBTL1KMT2A
SCHEMBL21917065 0.75 LOXL2 (0.34) GRM5CFTRALDH1A1KMT2A
SCHEMBL21917067 0.75 LOXL2 (0.34) GRM5CFTRALDH1A1KMT2A
SCHEMBL5647554 0.74 L3MBTL1 (0.53) L3MBTL1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10647671-B2 Promysalin analogues and methods of use thereof Temple University—Of the Commonwealth System of Higher Education (US) 2020-05-12 — — US disclosed
US-20190161444-A1 Novel Promysalin Analogues and Methods of Use Thereof Temple University--of the Commonwealth System of Higher Education 2019-05-30 — — US disclosed
WO-2017184558-A1 NOVEL PROMYSALIN ANALOGUES AND METHODS OF USE THEREOF TEMPLE UNIVERSITY-OF THE COMMONWEALTH SYSTEM OF HIGHER EDUCATION (US) 2017-10-26 — — 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-10647671-B2 Promysalin analogues and methods of use thereof CCL11, MAN2A1, PREP GRM5 2921/4885CFTR 546/4885ALDH1A1 2458/4885
US-20190161444-A1 Novel Promysalin Analogues and Methods of Use Thereof MASP2, MAN2A1, CCL11 GRM5 3246/4885CFTR 740/4885ALDH1A1 2906/4885

“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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