SCHEMBL23219322

SCHEMBL23219322

CN1C(=O)C2=C(CC=C2)N(C)c2nc(Cl)ncc21

nearest known ligand 0.33

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ SMN1; SMN2 Q16637 1/20 0.33
▸ MAPK7 Q13164 1/20 0.31
▸ ABL1 P00519 1/20 0.30
▸ BCR P11274 1/20 0.30
▸ PTK2 Q05397 1/20 0.30

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
SCHEMBL21938544 0.77 TNK2 (0.33) SMN1; SMN2
SCHEMBL29297663 0.69 SMN1; SMN2 (0.37) SMN1; SMN2ABL1BCR
SCHEMBL10098691 0.69 MAPK7 (0.56) MAPK7
SCHEMBL3542184 0.68 SMN1; SMN2 (0.40) SMN1; SMN2MAPK7ABL1BCR
SCHEMBL6844626 0.67 STK4 (0.49) SMN1; SMN2ABL1BCR
SCHEMBL20628431 0.67 STK3 (0.57) SMN1; SMN2MAPK7ABL1PTK2
SCHEMBL22658779 0.66 PTK2 (0.59) PTK2
SCHEMBL19457452 0.66 PIK3CD (0.56) MAPK7
SCHEMBL30131807 0.66 PIK3CD (0.56) MAPK7
SCHEMBL29517219 0.66 PTK2 (0.59) PTK2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10975092-B2 Pyrimidine seven-membered-ring compounds, preparation method therefor, pharmaceutical composition thereof, and uses thereof ANHUI NEW STAR PHARMACEUTICAL DEVELOPMENT CO., LTD. (CN) 2021-04-13 — — 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 (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-10975092-B2 Pyrimidine seven-membered-ring compounds, preparation method therefor, pharmaceutical composition thereof, and uses thereof MST1, STK11, MSTN SMN1; SMN2 517/4885MAPK7 112/4885ABL1 1204/4885

“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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