SCHEMBL24068172

SCHEMBL24068172

C=C(C)c1cnc2c(Cl)cc(Cl)cn12

nearest known ligand 0.38

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 1/20 0.32
▸ ALDH1A1 P00352 1/20 0.30
▸ MAPT P10636 1/20 0.30
▸ GMNN O75496 1/20 0.30
▸ LMNA P02545 1/20 0.30
▸ POLB P06746 1/20 0.30
▸ CYP3A4 P08684 1/20 0.30
▸ TSPO P30536 1/20 0.30
▸ BLM P54132 1/20 0.30
▸ NPSR1 Q6W5P4 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
SCHEMBL24068030 0.81 SMN1; SMN2 (0.40) KDM4EALDH1A1MAPTLMNAPOLB
SCHEMBL24068077 0.80 MEN1 (0.33) KDM4EALDH1A1LMNACYP3A4NPSR1
SCHEMBL24068085 0.74 KDM4E (0.35) KDM4EALDH1A1MAPTGMNNLMNA
SCHEMBL24068096 0.72 CHEK1 (0.43) ALDH1A1CYP3A4
SCHEMBL13193039 0.70 KDM4E (0.33) KDM4EMAPTLMNA
SCHEMBL24068083 0.70 KDM4E (0.33) KDM4E
SCHEMBL24068074 0.70 KDM4E (0.33) KDM4ELMNA
SCHEMBL21248397 0.68 — —
SCHEMBL21256133 0.67 — —
SCHEMBL24104013 0.60 HPGD (0.30) —

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115667257-B Compounds for inhibiting CDK7 伊莱利利公司 2024-06-11 — — CN disclosed
US-20230203031-A1 COMPOUNDS USEFUL FOR INHIBITING CDK7 ELI LILLY AND COMPANY 2023-06-29 — — US disclosed
US-20230203031-A1 COMPOUNDS USEFUL FOR INHIBITING CDK7 ELI LILLY AND COMPANY 2023-06-29 — — US disclosed
US-20230203031-A1 COMPOUNDS USEFUL FOR INHIBITING CDK7 ELI LILLY AND COMPANY 2023-06-29 — — US disclosed
EP-4157840-A1 COMPOUNDS USEFUL FOR INHIBITING CDK7 Eli Lilly and Company (US) 2023-04-05 — — EP disclosed
CN-115667257-A Compounds for inhibiting CDK7 伊莱利利公司 2023-01-31 — — CN disclosed
WO-2021242602-A1 COMPOUNDS USEFUL FOR INHIBITING CDK7 ELI LILLY AND COMPANY (US) 2021-12-02 — — 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-20230203031-A1 COMPOUNDS USEFUL FOR INHIBITING CDK7 CDK7, CDK3, CCNH KDM4E 430/4885ALDH1A1 3476/4885MAPT 3657/4885

“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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