SCHEMBL23877684

SCHEMBL23877684

Nc1cccc(Nc2ncc3cc(-c4ccccc4)c(=O)oc3n2)c1

nearest known ligand 0.75

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ ABL1 P00519 13/20 0.75
▸ SRC P12931 3/20 0.51
▸ BCR P11274 2/20 0.51
▸ EGFR P00533 1/20 0.51
▸ PRKACA P17612 1/20 0.51
▸ PRKACG P22612 1/20 0.51
▸ PRKACB P22694 1/20 0.51
▸ SYK P43405 2/20 0.47
▸ PDGFRB P09619 1/20 0.47
▸ PDGFRA P16234 1/20 0.47
▸ MAPK14 Q16539 1/20 0.47
▸ NPC1 O15118 1/20 0.46
▸ MAPT P10636 1/20 0.45
▸ MAP3K5 Q99683 1/20 0.43

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
SCHEMBL29557090 0.86 ABL1 (0.83) ABL1SRCBCREGFRPRKACA
SCHEMBL23877687 0.86 ABL1 (1.00) ABL1SRCBCREGFRPRKACA
SCHEMBL19662126 0.85 ABL1 (1.00) ABL1SRCBCREGFRSYK
SCHEMBL29557319 0.85 ABL1 (1.00) ABL1SRCBCREGFRSYK
SCHEMBL29557265 0.82 ABL1 (0.78) ABL1SRCBCREGFRPRKACA
SCHEMBL23879900 0.81 ABL1 (0.89) ABL1SRCEGFRPDGFRBPDGFRA
SCHEMBL29557918 0.81 ABL1 (0.87) ABL1SRCEGFRSYKPDGFRB
SCHEMBL29557437 0.75 ABL1 (0.82) ABL1SRCEGFRPDGFRBPDGFRA
SCHEMBL23877678 0.72 ABL1 (1.00) ABL1SRCEGFRPDGFRBPDGFRA
SCHEMBL29557026 0.72 ABL1 (1.00) ABL1SRCEGFRPDGFRBPDGFRA

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-20220096485-A1 FUNCTIONALIZED PYRANO[2,3-D]PYRIMIDIN-7-ONE DERIVATIVES AND METHODS FOR THEIR PREPARATION AND USE THE TEXAS A&M UNIVERSITY SYSTEM (US) 2022-03-31 — — US claimed
US-20220096485-A1 FUNCTIONALIZED PYRANO[2,3-D]PYRIMIDIN-7-ONE DERIVATIVES AND METHODS FOR THEIR PREPARATION AND USE THE TEXAS A&M UNIVERSITY SYSTEM (US) 2022-03-31 — — US disclosed
US-11136333-B2 Functionalized pyrano[2,3-D]pyrimidin-7-one derivatives and methods for their preparation and use THE TEXAS A&M UNIVERSITY SYSTEM (US) 2021-10-05 — — 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 (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-11136333-B2 Functionalized pyrano[2,3-D]pyrimidin-7-one derivatives and methods for their preparation and use MAP3K7, MAP4K2, MAP3K8 ABL1 145/4885SRC 344/4885BCR 1684/4885
US-20220096485-A1 FUNCTIONALIZED PYRANO[2,3-D]PYRIMIDIN-7-ONE DERIVATIVES AND METHODS FOR THEIR PREPARATION AND USE MAP3K7, MAP4K2, MAP3K8 ABL1 145/4885SRC 344/4885BCR 1684/4885

“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