SCHEMBL25656154

SCHEMBL25656154

Cc1cc2ncc(C#N)c(N3CCCN(CCN4C(=O)c5ccccc5C4=O)CC3)c2cc1C

nearest known ligand 0.80

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
ENPP1 P22413 3/20 0.80
HTR1A P08908 3/20 0.46
LRRK2 Q5S007 4/20 0.45
SRC P12931 2/20 0.39
PDGFRB P09619 4/20 0.39

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
SCHEMBL25656158 0.95 ENPP1 (0.72) ENPP1HTR1ALRRK2SRC
SCHEMBL23727241 0.89 ENPP1 (1.00) ENPP1HTR1ASRCPDGFRB
SCHEMBL30117251 0.89 ENPP1 (1.00) ENPP1HTR1ASRCPDGFRB
SCHEMBL30117257 0.84 ENPP1 (0.91) ENPP1HTR1APDGFRB
SCHEMBL23726534 0.84 ENPP1 (0.91) ENPP1HTR1APDGFRB
SCHEMBL25656153 0.82 ENPP1 (0.55) ENPP1LRRK2SRCPDGFRB
SCHEMBL29055035 0.81 ENPP1 (0.84) ENPP1SRCPDGFRB
SCHEMBL30080166 0.81 ENPP1 (0.84) ENPP1SRCPDGFRB
SCHEMBL25656157 0.80 ENPP1 (0.58) ENPP1LRRK2SRCPDGFRB
SCHEMBL25656016 0.78 ENPP1 (0.61) 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 1/4885HTR1A 4404/4885LRRK2 3715/4885

“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.