SCHEMBL21884427

SCHEMBL21884427

Cc1ccc(F)c(-c2c(C#N)ccc(O)c2C(=O)NC2=NCCN2)c1

nearest known ligand 0.42

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
NISCH Q9Y2I1 1/20 0.42
WDR5 P61964 15/20 0.37
LRRK2 Q5S007 1/20 0.36
HTT P42858 1/20 0.35
ADRA1D P25100 1/20 0.34
SLC6A3 Q01959 1/20 0.34

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
SCHEMBL21884437 0.91 WDR5 (0.35) NISCHWDR5LRRK2ADRA1DSLC6A3
SCHEMBL21884376 0.91 PDE4B (0.37) WDR5LRRK2ADRA1DSLC6A3
SCHEMBL21884432 0.90 TMPRSS4 (0.40) WDR5LRRK2HTT
SCHEMBL24066318 0.89 WDR5 (0.36) WDR5HTTADRA1D
SCHEMBL21884629 0.88 WDR5 (0.40) WDR5
SCHEMBL21884363 0.87 NISCH (0.41) NISCHWDR5ADRA1DSLC6A3
SCHEMBL21884371 0.85 ABL1 (0.36) NISCHWDR5ADRA1DSLC6A3
SCHEMBL21884365 0.83 NISCH (0.38) NISCHWDR5ADRA1DSLC6A3
SCHEMBL21884370 0.83 LRRK2 (0.38) WDR5LRRK2ADRA1DSLC6A3
SCHEMBL21884640 0.83 NISCH (0.35) NISCHWDR5HTTADRA1DSLC6A3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20210371403-A1 SMALL MOLECULES TARGETING MUTANT MAMMALIAN PROTEINS JNANA THERAPEUTICS INC. 2021-12-02 US disclosed
US-20210299070-A1 METHODS OF TREATING CREATINE TRANSPORTER DEFICIENCY JNANA THERAPEUTICS INC. 2021-09-30 US disclosed
WO-2020061473-A1 SMALL MOLECULES TARGETING MUTANT MAMMALIAN PROTEINS JNANA THERAPEUTICS, INC. (US) 2020-03-26 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-20210299070-A1 METHODS OF TREATING CREATINE TRANSPORTER DEFICIENCY SLC19A1, SLC1A5, SLC1A2 NISCH 1713/4885WDR5 3394/4885LRRK2 3750/4885
US-20210371403-A1 SMALL MOLECULES TARGETING MUTANT MAMMALIAN PROTEINS SNRPE, G3BP1, G3BP2 NISCH 4403/4885WDR5 1567/4885LRRK2 623/4885

“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.