SCHEMBL18474258

SCHEMBL18474258

CCOCCO/N=C(/C)N

nearest known ligand 0.41

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.41
TSHR P16473 1/20 0.41
THRB P10828 1/20 0.36

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
SCHEMBL18474182 0.78
SCHEMBL18474058 0.78
SCHEMBL17402478 0.77 NOS1 (0.40) ALDH1A1TSHR
SCHEMBL17395740 0.77 NOS1 (0.40) ALDH1A1TSHR
SCHEMBL6187224 0.75 ALDH1A1 (0.33) ALDH1A1TSHR
SCHEMBL18474063 0.74
SCHEMBL6183770 0.74 ALDH1A1 (0.32) ALDH1A1TSHR
SCHEMBL18474066 0.73
SCHEMBL18475261 0.70 MEN1 (0.34)
SCHEMBL20468135 0.68 ALDH1A1 (0.48) ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11084783-B2 O-alkyl-benzylideneguanidine derivatives and therapeutic use for the treatment of disorders associated with an accumulation of misfolded proteins INFLECTIS BIOSCIENCE (FR) 2021-08-10 US disclosed
US-10675257-B2 Method of treating cancer with a combination of benzylideneguanidine derivatives and chemotherapeutic agent INFLECTIS BIOSCIENCE (FR) 2020-06-09 US disclosed
US-20200102269-A1 O-ALKYL-BENZYLIDENEGUANIDINE DERIVATIVES AND THERAPEUTIC USE FOR THE TREATMENT OF DISORDERS ASSOCIATED WITH AN ACCUMULATION OF MISFOLDED PROTEINS INFLECTIS BIOSCIENCE (FR) 2020-04-02 US disclosed
US-10544093-B2 O-alkyl-benzylideneguanidine derivatives and therapeutic use for the treatment of disorders associated an accumulation of misfolded proteins INFLECTIS BIOSCIENCE (FR) 2020-01-28 US disclosed
US-20180221310-A1 METHOD OF TREATING CANCER WITH A COMBINATION OF BENZYLIDENEGUANIDINE DERIVATIVES AND CHEMOTHERAPEUTIC AGENT INFLECTIS BIOSCIENCE (FR) 2018-08-09 US disclosed
US-20170152220-A1 O-ALKYL-BENZYLIDENEGUANIDINE DERIVATIVES AND THERAPEUTIC USE FOR THE TREATMENT OF DISORDERS ASSOCIATED AN ACCUMULATION OF MISFOLDED PROTEINS INFLECTIS BIOSCIENCE (FR) 2017-06-01 US disclosed
WO-2017021216-A1 METHOD OF TREATING CANCER WITH A COMBINATION OF BENZYLIDENEGUANIDINE DERIVATIVES AND CHEMOTHERAPEUTIC AGENT. INFLECTIS BIOSCIENCE (FR) 2017-02-09 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 (6 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-20170152220-A1 O-ALKYL-BENZYLIDENEGUANIDINE DERIVATIVES AND THERAPEUTIC USE FOR THE TREATMENT OF DISORDERS ASSOCIATED AN ACCUMULATION OF MISFOLDED PROTEINS HSPA5, PRNP, MAPT ALDH1A1 2576/4885TSHR 3782/4885THRB 2162/4885
US-20200102269-A1 O-ALKYL-BENZYLIDENEGUANIDINE DERIVATIVES AND THERAPEUTIC USE FOR THE TREATMENT OF DISORDERS ASSOCIATED WITH AN ACCUMULATION OF MISFOLDED PROTEINS HSPA5, PRNP, TBCA ALDH1A1 2534/4885TSHR 3643/4885THRB 2038/4885
US-10544093-B2 O-alkyl-benzylideneguanidine derivatives and therapeutic use for the treatment of disorders associated an accumulation of misfolded proteins HSPA5, PRNP, MAPT ALDH1A1 2576/4885TSHR 3782/4885THRB 2162/4885
US-20180221310-A1 METHOD OF TREATING CANCER WITH A COMBINATION OF BENZYLIDENEGUANIDINE DERIVATIVES AND CHEMOTHERAPEUTIC AGENT MGMT, GLI1, CA9 ALDH1A1 148/4885TSHR 2145/4885THRB 3386/4885
US-10675257-B2 Method of treating cancer with a combination of benzylideneguanidine derivatives and chemotherapeutic agent MGMT, GLI1, CA9 ALDH1A1 148/4885TSHR 2145/4885THRB 3386/4885
US-11084783-B2 O-alkyl-benzylideneguanidine derivatives and therapeutic use for the treatment of disorders associated with an accumulation of misfolded proteins HSPA5, PRNP, TBCA ALDH1A1 2534/4885TSHR 3643/4885THRB 2038/4885

“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.