SCHEMBL17345976

SCHEMBL17345976

CSCCN(C)CCP(c1ccccc1)c1ccccc1

nearest known ligand 0.35

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
FDPS P14324 1/20 0.33
SIGMAR1 Q99720 3/20 0.33
KMT2A Q03164 1/20 0.33
HTR7 P34969 1/20 0.30
CARM1 Q86X55 1/20 0.30
PRMT6 Q96LA8 1/20 0.30
PRMT8 Q9NR22 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
SCHEMBL1466090 0.87 SIGMAR1 (0.39) SIGMAR1KMT2ACARM1PRMT6PRMT8
SCHEMBL17346107 0.85 FDPS (0.32) FDPSSIGMAR1KMT2A
SCHEMBL17345935 0.84 MAPT (0.30)
SCHEMBL17346043 0.83 FDPS (0.49) FDPSKMT2AHTR7
SCHEMBL17345984 0.82 HTR1A (0.40) FDPSSIGMAR1KMT2AHTR7
SCHEMBL17345986 0.82 SIGMAR1 (0.31) FDPSSIGMAR1KMT2A
SCHEMBL19248847 0.81
SCHEMBL17345978 0.81 CYP2C19 (0.39) SIGMAR1KMT2ACARM1PRMT6PRMT8
SCHEMBL17345993 0.80 KIF11 (0.44)
SCHEMBL8735569 0.79 CYP3A4 (0.36)

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-10550139-B2 Polydentate ligands and their complexes for molecular catalysis TRIAD NATIONAL SECURITY, LLC (US) 2020-02-04 US disclosed
US-20170088571-A1 POLYDENTATE LIGANDS AND THEIR COMPLEXES FOR MOLECULAR CATALYSIS TRIAD NATIONAL SECURITY, LLC 2017-03-30 US disclosed
US-20170088571-A1 POLYDENTATE LIGANDS AND THEIR COMPLEXES FOR MOLECULAR CATALYSIS TRIAD NATIONAL SECURITY, LLC 2017-03-30 US disclosed
WO-2015191505-A1 POLYDENTATE LIGANDS AND THEIR COMPLEXES FOR MOLECULAR CATALYSIS LOS ALAMOS NATIONAL SECURITY, LLC (US) 2015-12-17 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-20170088571-A1 POLYDENTATE LIGANDS AND THEIR COMPLEXES FOR MOLECULAR CATALYSIS NANS, NCL, NCLN FDPS 123/4885SIGMAR1 412/4885KMT2A 4514/4885
US-10550139-B2 Polydentate ligands and their complexes for molecular catalysis NANS, NCL, NCLN FDPS 123/4885SIGMAR1 412/4885KMT2A 4514/4885

“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.