SCHEMBL23579870

SCHEMBL23579870

Cn1ncc2c(NCc3ccc(S(N)(=O)=O)cc3)nc(NC3CC3)nc21

nearest known ligand 0.52

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ BCDIN3D Q7Z5W3 15/20 0.52
▸ PDE2A O00408 1/20 0.48
▸ HTR2C P28335 1/20 0.48
▸ KDM4E B2RXH2 1/20 0.47
▸ NPC1 O15118 1/20 0.47
▸ MAPT P10636 1/20 0.47
▸ SHMT2 P34897 1/20 0.46

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
SCHEMBL23579680 0.95 HTR2C (0.55) BCDIN3DPDE2AHTR2CSHMT2
SCHEMBL23579931 0.87 CA1 (0.60) BCDIN3DPDE2AHTR2CKDM4ENPC1
SCHEMBL30033469 0.87 CA1 (0.60) BCDIN3DPDE2AHTR2CKDM4ENPC1
SCHEMBL23580247 0.86 BCDIN3D (0.65) BCDIN3DPDE2AHTR2CKDM4ENPC1
SCHEMBL23579807 0.86 CA1 (0.62) BCDIN3DPDE2AHTR2CKDM4ENPC1
SCHEMBL23580265 0.84 BCDIN3D (0.56) BCDIN3DPDE2AKDM4ENPC1MAPT
SCHEMBL23579838 0.82 PDE5A (0.62) BCDIN3DHTR2CMAPT
SCHEMBL30034185 0.82 PDE5A (0.62) BCDIN3DHTR2CMAPT
SCHEMBL23579698 0.82 PDE2A (0.55) BCDIN3DPDE2AHTR2C
SCHEMBL23579797 0.82 PDE2A (0.55) BCDIN3DPDE2AKDM4ENPC1MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115151550-B External nucleotide pyrophosphatase/phosphodiesterase 1 (ENPP 1) modulators and uses thereof 桑福德·伯纳姆·普雷比医学发现研究所 2024-11-22 — — CN disclosed
US-20230121698-A1 ECTONUCLEOTIDE PYROPHOSPHATASE/PHOSPHODIESTERASE 1 (ENPP1) MODULATORS AND USES THEREOF Sanford Burnham Prebys Medical Discovery Institute 2023-04-20 — — US disclosed
EP-4081528-A1 ECTONUCLEOTIDE PYROPHOSPHATASE/PHOSPHODIESTERASE 1 (ENPP1) MODULATORS AND USES THEREOF Sanford Burnham Prebys Medical Discovery Institute (US) 2022-11-02 — — EP disclosed
CN-115151550-A Ectonucleotide pyrophosphatase/phosphodiesterase 1 (ENPP 1) modulators and uses thereof 桑福德·伯纳姆·普雷比医学发现研究所 2022-10-04 — — CN disclosed
WO-2021133915-A1 ECTONUCLEOTIDE PYROPHOSPHATASE/PHOSPHODIESTERASE 1 (ENPP1) MODULATORS AND USES THEREOF Sanford Burnham Prebys Medical Discovery Institute (US) 2021-07-01 — — WO disclosed
WO-2021133915-A1 ECTONUCLEOTIDE PYROPHOSPHATASE/PHOSPHODIESTERASE 1 (ENPP1) MODULATORS AND USES THEREOF Sanford Burnham Prebys Medical Discovery Institute (US) 2021-07-01 — — 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 (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-20230121698-A1 ECTONUCLEOTIDE PYROPHOSPHATASE/PHOSPHODIESTERASE 1 (ENPP1) MODULATORS AND USES THEREOF ENPP1, ENPP3, PPA1 BCDIN3D 582/4885PDE2A 37/4885HTR2C 4192/4885

“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.

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