SCHEMBL25656173

SCHEMBL25656173

Cc1cc2ncc(C#N)c(N3CCCN(C(=O)CNS(N)(=O)=O)CC3)c2cc1C

nearest known ligand 0.80

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
ENPP1 P22413 11/20 0.80
LRRK2 Q5S007 4/20 0.45
CHRM4 P08173 1/20 0.39
KDM4E B2RXH2 1/20 0.38
ALDH1A1 P00352 1/20 0.38
KMT2A Q03164 1/20 0.37
PDGFRB P09619 1/20 0.37

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
SCHEMBL25656178 0.91 ENPP1 (0.68) ENPP1LRRK2CHRM4KDM4EALDH1A1
SCHEMBL25656014 0.89 ENPP1 (0.63) ENPP1KDM4EALDH1A1
SCHEMBL23762340 0.89 ENPP1 (1.00) ENPP1PDGFRB
SCHEMBL25656171 0.86 ENPP1 (0.59) ENPP1LRRK2CHRM4KDM4EALDH1A1
SCHEMBL25656174 0.85 ENPP1 (0.62) ENPP1LRRK2KDM4EALDH1A1PDGFRB
SCHEMBL25656018 0.85 ENPP1 (0.59) ENPP1LRRK2KDM4EALDH1A1KMT2A
SCHEMBL25656172 0.85 ENPP1 (0.58) ENPP1LRRK2CHRM4KDM4EALDH1A1
SCHEMBL25656176 0.84 ENPP1 (0.58) ENPP1LRRK2CHRM4KDM4EALDH1A1
SCHEMBL25656156 0.82 ENPP1 (0.72) ENPP1LRRK2PDGFRB
SCHEMBL23726806 0.81 ENPP1 (0.82) ENPP1LRRK2PDGFRB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230183212-A1 INHIBITORS OF ECTONUCLEOTIDE PYROPHOSPHATASE/PHOSPHODIESTERASE 1 (ENPP1) AND METHODS OF USE THEREOF STINGRAY THERAPEUTICS INC (US) 2023-06-15 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 (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-20230183212-A1 INHIBITORS OF ECTONUCLEOTIDE PYROPHOSPHATASE/PHOSPHODIESTERASE 1 (ENPP1) AND METHODS OF USE THEREOF ENPP1, ENPP3, PPA1 ENPP1 1/4885LRRK2 3715/4885CHRM4 4366/4885

“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.