SCHEMBL23854891

SCHEMBL23854891

N#Cc1ccc(O)c(C(=O)N=C2NCCN2)c1-c1cn[nH]c1

nearest known ligand 0.33

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
BLM P54132 1/20 0.33
WRN Q14191 1/20 0.33
ROCK2 O75116 5/20 0.33
ROCK1 Q13464 4/20 0.33
PLK1 P53350 1/20 0.32
KDM5A P29375 1/20 0.31
UCHL1 P09936 1/20 0.31
IKBKE Q14164 1/20 0.30
TBK1 Q9UHD2 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
SCHEMBL21884792 0.83 MAOA (0.37) KDM5A
SCHEMBL23854845 0.83 KDM4E (0.38) KDM5A
SCHEMBL23854861 0.82 LRRK2 (0.33)
SCHEMBL23854847 0.79 RIPK3 (0.34) ROCK2
SCHEMBL21884557 0.79 MAOA (0.36)
SCHEMBL23854840 0.79 KDM5A (0.38) KDM5A
SCHEMBL21884795 0.77 KDM4E (0.38)
SCHEMBL23854838 0.77 AR (0.34)
SCHEMBL23854865 0.77 KDM4E (0.43)
SCHEMBL23854848 0.77 KDM5A (0.35) KDM5A

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-20210371403-A1 SMALL MOLECULES TARGETING MUTANT MAMMALIAN PROTEINS JNANA THERAPEUTICS INC. 2021-12-02 US disclosed
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
US-20210299070-A1 METHODS OF TREATING CREATINE TRANSPORTER DEFICIENCY JNANA THERAPEUTICS INC. 2021-09-30 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 (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 BLM 3168/4885WRN 2273/4885ROCK2 2146/4885
US-20210371403-A1 SMALL MOLECULES TARGETING MUTANT MAMMALIAN PROTEINS SNRPE, G3BP1, G3BP2 BLM 1606/4885WRN 2977/4885ROCK2 2173/4885

“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.