SCHEMBL17403671

SCHEMBL17403671

CC(C)(N=NC(C)(C)C(=O)NCCO)C(=O)NO

nearest known ligand 0.38

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
CNR1 P21554 1/20 0.38
MMP8 P22894 3/20 0.33
ALDH1A1 P00352 2/20 0.33
MEN1 O00255 1/20 0.33
USP2 O75604 1/20 0.33
MAPT P10636 1/20 0.33
KMT2A Q03164 1/20 0.33
CA14 Q9ULX7 1/20 0.31
TDP1 Q9NUW8 1/20 0.30

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
SCHEMBL17732616 0.92 CNR1 (0.41) CNR1ALDH1A1MEN1USP2MAPT
SCHEMBL35559 0.92 CNR1 (0.41) CNR1ALDH1A1MEN1USP2MAPT
SCHEMBL35560 0.92 CNR1 (0.41) CNR1ALDH1A1MEN1USP2MAPT
Water SCHEMBL31205630 0.90 CNR1 (0.41) CNR1ALDH1A1MEN1USP2MAPT
SCHEMBL12563617 0.85 CNR1 (0.41) CNR1ALDH1A1MEN1USP2MAPT
SCHEMBL15745360 0.85 CNR1 (0.38) CNR1ALDH1A1MEN1USP2MAPT
SCHEMBL11683038 0.83 CNR1 (0.37) CNR1ALDH1A1MEN1USP2MAPT
SCHEMBL17082484 0.81 CNR1 (0.36) CNR1ALDH1A1MEN1USP2MAPT
SCHEMBL7722036 0.81 CA2 (0.42) MMP8ALDH1A1MAPT
SCHEMBL7786764 0.81 CA3 (0.41) CNR1ALDH1A1MEN1KMT2ACA14

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10040916-B2 Functional polymer membrane and method for producing same FUJIFILM CORPORATION (JP) 2018-08-07 US disclosed
US-9999579-B2 Controlled release dual walled microcapsules THE PROCTER & GAMBLE COMPANY (US) 2018-06-19 US disclosed
US-9790338-B2 Ion exchange membrane and method for manufacturing the same FUJIFILM CORPORATION (JP) 2017-10-17 US disclosed
US-20170283735-A1 CONTROLLED RELEASE DUAL WALLED MICROCAPSULES ENCAPSYS, LLC (US) 2017-10-05 US disclosed
US-20170283736-A1 CONTROLLED RELEASE DUAL WALLED MICROCAPSULES ENCAPSYS, LLC (US) 2017-10-05 US disclosed
US-20170281986-A1 CONTROLLED RELEASE MICROCAPSULES ENCAPSYS, LLC (US) 2017-10-05 US disclosed
US-20170281985-A1 CONTROLLED RELEASE MICROCAPSULES ENCAPSYS, LLC (US) 2017-10-05 US disclosed
US-20170216162-A1 CONTROLLED RELEASE MICROCAPSULES THE PROCTER & GAMBLE COMPANY 2017-08-03 US disclosed
US-20170216163-A1 CONTROLLED RELEASE DUAL WALLED MICROCAPSULES THE PROCTER & GAMBLE COMPANY 2017-08-03 US disclosed
US-9714397-B2 Controlled release microcapsules ENCAPSYS LLC (US) 2017-07-25 US disclosed
US-9714396-B2 Controlled release dual walled microcapsules ENCAPSYS LLC (US) 2017-07-25 US disclosed
US-20160369073-A1 FUNCTIONAL POLYMER MEMBRANE AND METHOD FOR PRODUCING SAME FUJIFILM CORPORATION (JP) 2016-12-22 US disclosed
US-20160362526-A1 ION EXCHANGE MEMBRANE AND METHOD FOR MANUFACTURING THE SAME FUJIFILM CORPORATION (JP) 2016-12-15 US disclosed
US-20160236952-A1 ION EXCHANGE MEMBRANE ELECTRODE ASSEMBLY, METHOD FOR PRODUCING SAME, AND CAPACITOR DEIONIZATION DEVICE FUJIFILM CORPORATION (JP) 2016-08-18 US disclosed
US-20160108339-A1 CONTROLLED RELEASE DUAL WALLED MICROCAPSULES ENCAPSYS LLC (US) 2016-04-21 US disclosed
US-20160108340-A1 CONTROLLED RELEASE MICROCAPSULES ENCAPSYS LLC (US) 2016-04-21 US disclosed
US-20160001238-A1 POLYMER FUNCTIONAL FILM AND METHOD FOR PRODUCING SAME FUJIFILM CORPORATION (JP) 2016-01-07 US 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-20170283736-A1 CONTROLLED RELEASE DUAL WALLED MICROCAPSULES MYADM, MCHR2, MCHR1 CNR1 3651/4885MMP8 4093/4885ALDH1A1 4279/4885
US-20170216163-A1 CONTROLLED RELEASE DUAL WALLED MICROCAPSULES MYADM, MCHR2, MCHR1 CNR1 3651/4885MMP8 4093/4885ALDH1A1 4279/4885
US-20170283735-A1 CONTROLLED RELEASE DUAL WALLED MICROCAPSULES MYADM, MCHR2, MCHR1 CNR1 3651/4885MMP8 4093/4885ALDH1A1 4279/4885
US-20170216162-A1 CONTROLLED RELEASE MICROCAPSULES NSF, CRH, CHMP4B CNR1 2005/4885MMP8 1992/4885ALDH1A1 4860/4885

“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.