SCHEMBL25841307

SCHEMBL25841307

Cc1ccc2c(N3CCC(CCP(=O)(O)O)CC3)ncnc2c1-n1ccnc1

nearest known ligand 0.57

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ ENPP1 P22413 19/20 0.57
▸ ENPP3 O14638 1/20 0.38
▸ CYP1A2 P05177 1/20 0.36
▸ CYP2D6 P10635 1/20 0.36

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
SCHEMBL24015442 0.89 ENPP1 (0.67) ENPP1ENPP3
SCHEMBL31502050 0.89 ENPP1 (0.67) ENPP1ENPP3
SCHEMBL25841313 0.84 ENPP1 (0.57) ENPP1ENPP3CYP1A2CYP2D6
SCHEMBL25841317 0.81 ENPP1 (0.65) ENPP1ENPP3CYP1A2CYP2D6
SCHEMBL20814054 0.80 ENPP1 (0.60) ENPP1ENPP3CYP1A2CYP2D6
SCHEMBL22299711 0.79 ENPP1 (0.71) ENPP1
SCHEMBL20814056 0.74 ENPP1 (0.67) ENPP1
SCHEMBL22291144 0.74 ENPP1 (0.77) ENPP1ENPP3
SCHEMBL29857429 0.74 ENPP1 (0.77) ENPP1ENPP3
SCHEMBL20813411 0.73 ENPP1 (0.78) ENPP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230277570-A1 ENPP1 Inhibitors and Their Use for the Treatment of Cancer THE BOARD OF TRUSTEES OF THE LELAND STANFORD JUNIOR UNIVERSITY 2023-09-07 — — US disclosed
US-11707471-B2 ENPP1 inhibitors and their use for the treatment of cancer THE BOARD OF TRUSTEES OF THE LELAND STANFORD JUNIOR UNIVERSITY (US) 2023-07-25 — — US disclosed
US-11701371-B2 ENPP1 inhibitors and their use for the treatment of cancer THE BOARD OF TRUSTEES OF THE LELAND STANFORD JUNIOR UNIVERSITY (US) 2023-07-18 — — 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 (3 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-11701371-B2 ENPP1 inhibitors and their use for the treatment of cancer ENPP1, ENPP3, ENTPD1 ENPP1 1/4885ENPP3 2/4885CYP1A2 4507/4885
US-11707471-B2 ENPP1 inhibitors and their use for the treatment of cancer ENPP1, ENPP3, ENTPD1 ENPP1 1/4885ENPP3 2/4885CYP1A2 4507/4885
US-20230277570-A1 ENPP1 Inhibitors and Their Use for the Treatment of Cancer ENPP1, ENPP3, ENTPD1 ENPP1 1/4885ENPP3 2/4885CYP1A2 4507/4885

“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.

Send feedback