SCHEMBL30382604

SCHEMBL30382604

CC(C)n1nccc1-c1ncccc1CN

nearest known ligand 0.53

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ CYP1A2 P05177 1/20 0.53
▸ CYP3A4 P08684 1/20 0.53
▸ CYP2C8 P10632 1/20 0.53
▸ CYP2C9 P11712 1/20 0.53
▸ CYP2C19 P33261 1/20 0.53
▸ DPP4 P27487 1/20 0.43
▸ NR3C2 P08235 1/20 0.38
▸ PDE1A P54750 2/20 0.33
▸ PDE1B Q01064 2/20 0.33
▸ PDE1C Q14123 2/20 0.33
▸ MAP3K12 Q12852 1/20 0.32
▸ PRMT5 O14744 1/20 0.32
▸ WDR77 Q9BQA1 1/20 0.32
▸ CCR9 P51686 1/20 0.31
▸ RET P07949 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
SCHEMBL25022433 1.00 CYP1A2 (0.53) CYP1A2CYP3A4CYP2C8CYP2C9CYP2C19
SCHEMBL21271519 0.87 CYP1A2 (0.54) CYP1A2CYP3A4CYP2C8CYP2C9CYP2C19
SCHEMBL19600203 0.87 CYP1A2 (0.57) CYP1A2CYP3A4CYP2C8CYP2C9CYP2C19
SCHEMBL19606106 0.85 CYP1A2 (0.53) CYP1A2CYP3A4CYP2C8CYP2C9CYP2C19
SCHEMBL19605454 0.85 CYP1A2 (0.53) CYP1A2CYP3A4CYP2C8CYP2C9CYP2C19
SCHEMBL24026838 0.85 CYP1A2 (0.53) CYP1A2CYP3A4CYP2C8CYP2C9CYP2C19
SCHEMBL15083754 0.85 CYP1A2 (0.53) CYP1A2CYP3A4CYP2C8CYP2C9CYP2C19
SCHEMBL15065399 0.85 CYP1A2 (0.56) CYP1A2CYP3A4CYP2C8CYP2C9CYP2C19
Hydrochloric Acid SCHEMBL15068393 0.84 CYP1A2 (0.52) CYP1A2CYP3A4CYP2C8CYP2C9CYP2C19
Hydrochloric Acid SCHEMBL19583170 0.84 CYP1A2 (0.52) CYP1A2CYP3A4CYP2C8CYP2C9CYP2C19

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240352016-A1 A CYCLIN-DEPENDENT KINASE INHIBITOR TAIZHOU EOC PHARMA CO., LTD (CN) 2024-10-24 — — US disclosed
EP-4380930-A1 A CYCLIN-DEPENDENT KINASE INHIBITOR Taizhou Eoc Pharma Co., Ltd. (CN) 2024-06-12 — — EP disclosed
CN-117916235-A Cyclin dependent kinase inhibitors 泰州亿腾景昂药业股份有限公司 2024-04-19 — — CN disclosed
WO-2023016477-A1 A CYCLIN-DEPENDENT KINASE INHIBITOR Taizhou Eoc Pharma Co., Ltd. (CN) 2023-02-16 — — 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 (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-20240352016-A1 A CYCLIN-DEPENDENT KINASE INHIBITOR CDK2, CCNK, CDK1 CYP1A2 2867/4885CYP3A4 2055/4885CYP2C8 1548/4885

“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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