SCHEMBL24068096

SCHEMBL24068096

C=C(C)c1cnc2c(NC3CCNCC3)cc(Cl)cn12

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CHEK1 O14757 3/20 0.43
▸ MAPKAPK2 P49137 3/20 0.43
▸ FLT3 P36888 3/20 0.38
▸ IRAK1 P51617 2/20 0.38
▸ IRAK4 Q9NWZ3 2/20 0.38
▸ LCK P06239 1/20 0.38
▸ RET P07949 1/20 0.38
▸ PDGFRB P09619 1/20 0.38
▸ CDK7 P50613 1/20 0.38
▸ BLK P51451 1/20 0.38
▸ CCNH P51946 1/20 0.38
▸ AXL P30530 4/20 0.36
▸ TYRO3 Q06418 4/20 0.36
▸ MERTK Q12866 3/20 0.36
▸ TYK2 P29597 3/20 0.35
▸ JAK2 O60674 1/20 0.35
▸ JAK1 P23458 1/20 0.35
▸ JAK3 P52333 1/20 0.35
▸ BPTF Q12830 2/20 0.34
▸ ABL1 P00519 1/20 0.34

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
SCHEMBL25730278 0.88 TYK2 (0.37) CHEK1MAPKAPK2FLT3IRAK1IRAK4
SCHEMBL25730279 0.86 TYK2 (0.33) CHEK1MAPKAPK2IRAK4LCKTYK2
SCHEMBL24068103 0.78 CNR1 (0.47) JAK1CCNT1ALDH1A1
SCHEMBL25235366 0.73 CCR2 (0.34) —
SCHEMBL24068172 0.72 KDM4E (0.32) ALDH1A1CYP3A4
SCHEMBL24068059 0.64 MAPK1 (0.43) CHEK1FLT3IRAK4TYK2JAK2
SCHEMBL31619957 0.60 MAPK1 (0.64) FLT3IRAK1IRAK4LCKRET
SCHEMBL25730233 0.60 — —
SCHEMBL5774301 0.60 CYP1A2 (0.41) FLT3IRAK1IRAK4LCKRET
SCHEMBL18829880 0.60 DDR1 (0.43) ABL1

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 6 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
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 CHEK1 100/4885MAPKAPK2 337/4885FLT3 1907/4885

“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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