SCHEMBL24289368

SCHEMBL24289368

CC(C)(C)OC(=O)NCCCCCCn1ncc(I)c1C=O

nearest known ligand 0.45

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ TDP1 Q9NUW8 1/20 0.45
▸ MAOA P21397 1/20 0.43
▸ MAOB P27338 1/20 0.43
▸ DRD2 P14416 7/20 0.41
▸ CYP3A4 P08684 1/20 0.41
▸ PIM1 P11309 1/20 0.40
▸ PIM3 Q86V86 1/20 0.40
▸ CACNA1G O43497 1/20 0.39
▸ CA12 O43570 3/20 0.39
▸ CA1 P00915 3/20 0.39
▸ CA2 P00918 3/20 0.39
▸ CA9 Q16790 3/20 0.39
▸ STK17B O94768 1/20 0.39
▸ STK17A Q9UEE5 1/20 0.39
▸ MIF P14174 1/20 0.38

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
SCHEMBL25408932 0.83 TDP1 (0.41) TDP1MAOAMAOBDRD2CYP3A4
SCHEMBL27091159 0.82 PTGIR (0.32) —
SCHEMBL24289363 0.81 TDP1 (0.44) TDP1MAOAMAOBDRD2CYP3A4
SCHEMBL29800785 0.73 TDP1 (0.47) TDP1MAOAMAOBDRD2CYP3A4
SCHEMBL24289892 0.72 TDP1 (0.49) TDP1MAOAMAOBDRD2CA12
SCHEMBL20139538 0.72 DRD2 (0.40) TDP1DRD2STK17BSTK17A
SCHEMBL26291939 0.71 TDP1 (0.42) TDP1MAOAMAOBDRD2CYP3A4
SCHEMBL31746641 0.70 BRD4 (0.52) TDP1CYP3A4
SCHEMBL25056442 0.70 ALDH1A1 (0.46) TDP1DRD2CA1CA2STK17B
SCHEMBL5162656 0.70 TDP1 (0.85) TDP1MAOAMAOBDRD2CYP3A4

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-20240050428-A1 COMPOUNDS AND METHODS OF TREATING CANCERS CULLGEN (SHANGHAI), INC. (CN) 2024-02-15 — — US disclosed
WO-2022073469-A1 COMPOUNDS AND METHODS OF TREATING CANCERS CULLGEN (SHANGHAI) , INC. (CN) 2022-04-14 — — 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-20240050428-A1 COMPOUNDS AND METHODS OF TREATING CANCERS GSPT1, GGT1, VHL TDP1 246/4885MAOA 1673/4885MAOB 1155/4885

“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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