SCHEMBL22291011

SCHEMBL22291011

COc1cccc2c(-c3ccc(CCP(=O)(O)O)cc3)ncnc12

nearest known ligand 0.50

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ ENPP1 P22413 2/20 0.50
▸ TRPA1 O75762 1/20 0.38
▸ FDPS P14324 1/20 0.37
▸ HTR1A P08908 2/20 0.37
▸ ADRA1D P25100 2/20 0.37
▸ ADRA1A P35348 2/20 0.37
▸ ADRA1B P35368 2/20 0.37
▸ PDE5A O76074 1/20 0.37
▸ AURKA O14965 2/20 0.36
▸ RPS6KB1 P23443 2/20 0.36
▸ EGFR P00533 3/20 0.35
▸ POLB P06746 1/20 0.35
▸ FGFR2 P21802 1/20 0.35
▸ BTK Q06187 2/20 0.35

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
SCHEMBL20813395 0.81 KIT (0.50) ENPP1AURKAEGFR
SCHEMBL31400270 0.81 KIT (0.50) ENPP1AURKAEGFR
SCHEMBL22300383 0.81 EGFR (0.53) ENPP1PDE5AAURKARPS6KB1EGFR
SCHEMBL24009039 0.78 HTR1A (0.36) ENPP1TRPA1HTR1AADRA1DADRA1A
SCHEMBL19390600 0.77 HTR1A (0.42) HTR1AADRA1DADRA1AADRA1BEGFR
SCHEMBL17178224 0.76 TNKS (0.50) HTR1AADRA1DADRA1AADRA1BEGFR
SCHEMBL24009016 0.75 CDK2 (0.42) ENPP1HTR1AADRA1DADRA1AADRA1B
SCHEMBL13313198 0.75 ADORA2A (0.51) HTR1AADRA1DADRA1AADRA1BEGFR
SCHEMBL25841384 0.72 FDPS (0.41) ENPP1FDPSBTK
SCHEMBL17174414 0.70 TNKS (0.40) ENPP1HTR1AADRA1DADRA1AADRA1B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20250059218-A1 ENPP1 Inhibitors and Methods of Modulating Immune Response THE BOARD OF TRUSTEES OF THE LELAND STANFORD JUNIOR UNIVERSITY 2025-02-20 — — US disclosed
CN-113677350-B ENPP1 inhibitors and methods of modulating immune responses 里兰斯坦福初级大学理事会 2025-01-14 — — CN disclosed
US-20220289775-A1 ENPP1 Inhibitors and Methods of Modulating Immune Response NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2022-09-15 — — US disclosed
EP-3917536-A1 ENPP1 INHIBITORS AND METHODS OF MODULATING IMMUNE RESPONSE The Board of Trustees of the Leland Stanford Junior University (US) 2021-12-08 — — EP disclosed
CN-113677350-A ENPP1 inhibitors and methods of modulating immune responses 里兰斯坦福初级大学理事会 2021-11-19 — — CN disclosed
WO-2020160333-A1 ENPP1 INHIBITORS AND METHODS OF MODULATING IMMUNE RESPONSE THE BOARD OF TRUSTEES OF THE LELAND STANFORD JUNIOR UNIVERSITY (US) 2020-08-06 — — WO disclosed
WO-2020160333-A1 ENPP1 INHIBITORS AND METHODS OF MODULATING IMMUNE RESPONSE THE BOARD OF TRUSTEES OF THE LELAND STANFORD JUNIOR UNIVERSITY (US) 2020-08-06 — — 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 (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-20220289775-A1 ENPP1 Inhibitors and Methods of Modulating Immune Response ENPP1, STING1, ENPP2 ENPP1 1/4885TRPA1 4790/4885FDPS 2831/4885
US-20250059218-A1 ENPP1 Inhibitors and Methods of Modulating Immune Response ENPP1, STING1, ENPP2 ENPP1 1/4885TRPA1 4790/4885FDPS 2831/4885

“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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