SCHEMBL2551598

SCHEMBL2551598

CC(C)(C)C(=O)N[C@@H](CC(=O)O)C(=O)O

nearest known ligand 0.59

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
CA2 P00918 3/20 0.47
CA4 P22748 1/20 0.47
MME P08473 5/20 0.41
FNTA P49354 2/20 0.40
FNTB P49356 2/20 0.40
GAA P10253 1/20 0.39
MAPT P10636 1/20 0.39
GNPAT O15228 1/20 0.38
CA1 P00915 1/20 0.38
CASP3 P42574 1/20 0.37

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
SCHEMBL2551596 1.00 CA2 (0.47) CA2CA4MMEFNTAFNTB
SCHEMBL15605968 1.00 CA2 (0.47) CA2CA4MMEFNTAFNTB
SCHEMBL25928849 0.86 ACE (0.36) CA2CA4MMEMAPT
SCHEMBL31181187 0.84 CA2 (0.44) CA2CA4MMEFNTAFNTB
SCHEMBL12426670 0.84 CA2 (0.44) CA2CA4MMEFNTAFNTB
SCHEMBL14009447 0.84 CA2 (0.44) CA2CA4MMEFNTAFNTB
SCHEMBL5191274 0.84 ECE1 (0.50) CA2MMECA1
SCHEMBL12426218 0.82 RIPK1 (0.44) CA2CA4MMEFNTAFNTB
SCHEMBL11940951 0.82 RIPK1 (0.44) CA2CA4MMEFNTAFNTB
SCHEMBL21515914 0.81 ALDH1A1 (0.41) CA2CA4MME

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 23 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3473249-A1 CROSSLINKABLE DENDRIMERS Wayne State University (US) 2019-04-24 EP claimed
US-20170028075-A1 INJECTABLE DENDRIMER HYDROGEL NANOPARTICLES Ashvattha Therapeutics, Inc. 2017-02-02 US claimed
US-9526794-B2 Injectable dendrimer hydrogel nanoparticles WAYNE STATE UNIVERSITY (US) 2016-12-27 US claimed
US-20130136697-A1 INJECTABLE DENDRIMER HYDROGEL NANOPARTICLES NATIONAL INSTITUTES OF HEALTH (US) 2013-05-30 US claimed
EP-2552458-A1 INJECTABLE DENDRIMER HYDROGEL NANOPARTICLES Wayne State University (US) 2013-02-06 EP claimed
WO-2011123591-A1 INJECTABLE DENDRIMER HYDROGEL NANOPARTICLES WAYNE STATE UNIVERSITY (US) 2011-10-06 WO claimed
US-11446238-B2 Injectable dendrimer hydrogel nanoparticles WAYNE STATE UNIVERSITY (US) 2022-09-20 US disclosed
US-11149002-B2 Therapeutic compounds and methods of use thereof GENENTECH, INC. (US) 2021-10-19 US disclosed
US-20210078947-A1 THERAPEUTIC COMPOUNDS AND METHODS OF USE THEREOF GENENTECH, INC. (US) 2021-03-18 US disclosed
EP-3473249-A1 CROSSLINKABLE DENDRIMERS Wayne State University (US) 2019-04-24 EP disclosed
US-20190031607-A1 THERAPEUTIC COMPOUNDS AND METHODS OF USE THEREOF GENENTECH, INC. (US) 2019-01-31 US disclosed
US-10005724-B2 Therapeutic compounds and methods of use thereof GENENTECH, INC. (US) 2018-06-26 US disclosed
US-20170190662-A1 THERAPEUTIC COMPOUNDS AND METHODS OF USE THEREOF GENENTECH, INC. (US) 2017-07-06 US disclosed
US-20140221667-A1 FACTOR VIIA INHIBITOR PHARMACYCLICS, INC. (US) 2014-08-07 US disclosed
US-8729117-B2 Factor VIIa inhibitor PHARMACYCLICS, INC. (US) 2014-05-20 US disclosed
US-20140080879-A1 FACTOR VIIA INHIBITOR PHARMACYCLICS, INC. (US) 2014-03-20 US disclosed
US-20130136697-A1 INJECTABLE DENDRIMER HYDROGEL NANOPARTICLES NATIONAL INSTITUTES OF HEALTH (US) 2013-05-30 US disclosed
US-8415328-B2 Factor VIIa inhibitor PHARMACYCLICS, INC (US) 2013-04-09 US disclosed
EP-2552458-A1 INJECTABLE DENDRIMER HYDROGEL NANOPARTICLES Wayne State University (US) 2013-02-06 EP disclosed
WO-2011123591-A1 INJECTABLE DENDRIMER HYDROGEL NANOPARTICLES WAYNE STATE UNIVERSITY (US) 2011-10-06 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 (10 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-20170190662-A1 THERAPEUTIC COMPOUNDS AND METHODS OF USE THEREOF RDX, C1R, MTX1 CA2 2582/4885CA4 1724/4885MME 398/4885
US-11149002-B2 Therapeutic compounds and methods of use thereof RDX, C1R, MTX1 CA2 2582/4885CA4 1724/4885MME 398/4885
US-20170028075-A1 INJECTABLE DENDRIMER HYDROGEL NANOPARTICLES PAM, UACA, FLT1 CA2 4153/4885CA4 4629/4885MME 4177/4885
US-20190031607-A1 THERAPEUTIC COMPOUNDS AND METHODS OF USE THEREOF RDX, C1R, MTX1 CA2 2582/4885CA4 1724/4885MME 398/4885
US-10005724-B2 Therapeutic compounds and methods of use thereof RDX, C1R, MTX1 CA2 2582/4885CA4 1724/4885MME 398/4885
US-20140080879-A1 FACTOR VIIA INHIBITOR F7, F9, F5 CA2 3556/4885CA4 2395/4885MME 1854/4885
US-20140221667-A1 FACTOR VIIA INHIBITOR F7, F9, F5 CA2 3556/4885CA4 2395/4885MME 1854/4885
US-20130136697-A1 INJECTABLE DENDRIMER HYDROGEL NANOPARTICLES UACA, PAM, JAK3 CA2 4339/4885CA4 4584/4885MME 4232/4885
US-11446238-B2 Injectable dendrimer hydrogel nanoparticles PAM, UACA, FLT1 CA2 4153/4885CA4 4629/4885MME 4177/4885
US-20210078947-A1 THERAPEUTIC COMPOUNDS AND METHODS OF USE THEREOF RDX, C1R, MTX1 CA2 2582/4885CA4 1724/4885MME 398/4885

“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.