SCHEMBL19807529

SCHEMBL19807529

CNc1ncnc2c1ncn2[C@H]1[C@H](O)[C@H](O)[C@]2(COP(=O)(O)OP(=O)(O)OP(=O)(O)O)CC[C@H]12

nearest known ligand 0.84

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ P2RY1 P47900 11/20 0.84
▸ P2RY2 P41231 5/20 0.84
▸ P2RY11 Q96G91 1/20 0.64
▸ ADORA3 P0DMS8 2/20 0.53
▸ GPR17 Q13304 1/20 0.48
▸ P2RX3 P56373 1/20 0.46
▸ P2RX2 Q9UBL9 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
SCHEMBL19464971 0.99 P2RY1 (0.83) P2RY1P2RY2P2RY11ADORA3GPR17
SCHEMBL26934769 0.92 P2RY1 (1.00) P2RY1P2RY2P2RY11ADORA3
SCHEMBL26934770 0.91 P2RY1 (0.98) P2RY1P2RY2P2RY11ADORA3
SCHEMBL21710863 0.91 P2RY1 (0.98) P2RY1P2RY2P2RY11ADORA3
SCHEMBL19464972 0.88 P2RY1 (0.85) P2RY1P2RY2P2RY11ADORA3GPR17
SCHEMBL19807530 0.87 P2RY1 (0.65) P2RY1P2RY2P2RY11ADORA3GPR17
SCHEMBL19807425 0.87 P2RY1 (0.84) P2RY1P2RY2P2RY11ADORA3
SCHEMBL19464929 0.86 P2RY1 (0.68) P2RY1P2RY2P2RY11ADORA3P2RX3
SCHEMBL19464975 0.86 P2RY1 (0.82) P2RY1P2RY2P2RY11ADORA3P2RX3
SCHEMBL19464930 0.85 P2RY1 (0.68) P2RY1P2RY2P2RY11ADORA3P2RX3

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-10953031-B2 Compounds and methods for treating neurological and cardiovascular conditions ASTROCYTE PHARMACEUTICALS, INC. (US) 2021-03-23 — — US disclosed
US-20200046751-A1 COMPOUNDS AND METHODS FOR TREATING NEUROLOGICAL AND CARDIOVASCULAR CONDITIONS ASTROCYTE PHARMACEUTICALS, INC. 2020-02-13 — — US disclosed
US-10265338-B2 Compounds and methods for treating neurological and cardiovascular conditions ASTROCYTE PHARMACEUTICALS, INC. (US) 2019-04-23 — — US disclosed
US-20180021363-A1 COMPOUNDS AND METHODS FOR TREATING NEUROLOGICAL AND CARDIOVASCULAR CONDITIONS ASTROCYTE PHARMACEUTICALS, INC. 2018-01-25 — — 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 (4 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-10265338-B2 Compounds and methods for treating neurological and cardiovascular conditions TNNI3, CPT1B, TNNT2 P2RY1 1828/4885P2RY2 1796/4885P2RY11 2159/4885
US-20180021363-A1 COMPOUNDS AND METHODS FOR TREATING NEUROLOGICAL AND CARDIOVASCULAR CONDITIONS TNNI3, CPT1B, TNNT2 P2RY1 1828/4885P2RY2 1796/4885P2RY11 2159/4885
US-10953031-B2 Compounds and methods for treating neurological and cardiovascular conditions TNNI3, CPT1B, TNNT2 P2RY1 1828/4885P2RY2 1796/4885P2RY11 2159/4885
US-20200046751-A1 COMPOUNDS AND METHODS FOR TREATING NEUROLOGICAL AND CARDIOVASCULAR CONDITIONS TNNI3, CPT1B, TNNT2 P2RY1 1828/4885P2RY2 1796/4885P2RY11 2159/4885

“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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