SCHEMBL29847679

SCHEMBL29847679

CN(C)CCOc1ccc(-c2nccc3cnc(Nc4ccc(N5CCOCC5)nc4)nc23)cc1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CDK2 P24941 3/20 0.45
▸ TTK P33981 2/20 0.45
▸ CCNA2 P20248 1/20 0.45
▸ ZAP70 P43403 1/20 0.43
▸ IKBKB O14920 1/20 0.43
▸ CDK4 P11802 3/20 0.42
▸ GSK3B P49841 1/20 0.42
▸ EGFR P00533 3/20 0.42
▸ ERBB3 P21860 3/20 0.42
▸ CCND1 P24385 2/20 0.42
▸ CCND2 P30279 1/20 0.42
▸ CCND3 P30281 1/20 0.42
▸ MTOR P42345 2/20 0.41
▸ CSF1R P07333 1/20 0.41
▸ DAPK1 P53355 1/20 0.41
▸ KCNH2 Q12809 1/20 0.41
▸ PIK3CA P42336 2/20 0.41
▸ PIK3CG P48736 1/20 0.41
▸ CDK1 P06493 2/20 0.40
▸ KDR P35968 1/20 0.40

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
SCHEMBL16513670 1.00 CDK2 (0.45) CDK2TTKCCNA2ZAP70IKBKB
SCHEMBL16515298 0.91 CDK2 (0.49) CDK2TTKCCNA2IKBKBCDK4
SCHEMBL29847518 0.91 CDK2 (0.49) CDK2TTKCCNA2IKBKBCDK4
SCHEMBL16515089 0.91 BRAF (0.44) CDK2TTKCCNA2ZAP70EGFR
SCHEMBL29847932 0.91 BRAF (0.44) CDK2TTKCCNA2ZAP70EGFR
SCHEMBL16823283 0.90 CDK2 (0.41) CDK2TTKCCNA2ZAP70IKBKB
SCHEMBL16515086 0.90 MYLK4 (0.46) CDK2TTKCCNA2ZAP70IKBKB
SCHEMBL31679055 0.90 MYLK4 (0.46) CDK2TTKCCNA2ZAP70IKBKB
SCHEMBL16823103 0.89 ZAP70 (0.42) CDK2TTKCCNA2ZAP70CDK4
SCHEMBL16514778 0.88 CDK1 (0.50) CDK2TTKCCNA2ZAP70EGFR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12403145-B2 Substituted quinazolines for inhibiting kinase activity NEUPHARMA, INC (US) 2025-09-02 — — US claimed
CN-109851617-B Chemical entities, compositions, and methods 润新生物公司 2022-08-16 — — CN 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-12403145-B2 Substituted quinazolines for inhibiting kinase activity DCK, ABL1, MAP4K2 CDK2 35/4885TTK 18/4885CCNA2 612/4885

“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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