SCHEMBL4211031

SCHEMBL4211031

COCOc1ccccc1-c1cc(-c2ccc(OC)c(C(=O)O)c2)c(C#N)c(NC(=O)c2cccs2)n1

nearest known ligand 0.56

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
KISS1R Q969F8 19/20 0.56
MEN1 O00255 1/20 0.43
POLB P06746 1/20 0.43
KMT2A Q03164 1/20 0.43

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
SCHEMBL4217423 0.94 KISS1R (0.53) KISS1RMEN1KMT2A
SCHEMBL5017428 0.92 KISS1R (0.52) KISS1R
SCHEMBL4205801 0.91 KISS1R (0.54) KISS1RMEN1KMT2A
SCHEMBL4217888 0.89 KISS1R (0.61) KISS1R
SCHEMBL4205536 0.89 KISS1R (0.59) KISS1RMEN1KMT2A
SCHEMBL4210388 0.88 KISS1R (0.73) KISS1R
SCHEMBL4217598 0.87 KISS1R (0.47) KISS1R
SCHEMBL5065155 0.86 KISS1R (0.53) KISS1RMEN1KMT2A
SCHEMBL4204198 0.85 KISS1R (0.64) KISS1R
SCHEMBL5136062 0.85 KISS1R (0.50) KISS1RMEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090156646-A1 PYRIDYLPHENOL COMPOUND AND USE THEREOF TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2009-06-18 US disclosed
EP-1921066-A1 PYRIDYLPHENOL COMPOUND AND USE THEREOF Takeda Pharmaceutical Company Limited (JP) 2008-05-14 EP 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 (1 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-20090156646-A1 PYRIDYLPHENOL COMPOUND AND USE THEREOF GNRHR, PGR, MC1R KISS1R 16/4885MEN1 64/4885POLB 2582/4885

“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.