SCHEMBL29617217

SCHEMBL29617217

COc1ccc(OC(=O)COCCOCCNC(=O)CCCC[C@@H]2SC[C@@H]3NC(=O)N[C@@H]32)cc1Cl

nearest known ligand 0.66

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PKM P14618 2/20 0.66
▸ FLT1 P17948 2/20 0.54
▸ FLT4 P35916 2/20 0.54
▸ KDR P35968 2/20 0.54
▸ PRSS1 P07477 2/20 0.54
▸ PRSS2 P07478 2/20 0.54
▸ PRSS3 P35030 2/20 0.54
▸ TPSAB1 Q15661 2/20 0.54
▸ F2 P00734 1/20 0.54
▸ MAPK3 P27361 1/20 0.49
▸ CSNK2A2 P19784 1/20 0.49
▸ CSNK2B P67870 1/20 0.49
▸ CSNK2A1 P68400 1/20 0.49
▸ CAMK2B Q13554 1/20 0.49
▸ FOLH1 Q04609 5/20 0.49
▸ TDP1 Q9NUW8 2/20 0.49
▸ LY6K Q17RY6 1/20 0.48
▸ PLG P00747 1/20 0.48
▸ HSP90AB1 P08238 1/20 0.48
▸ GIGYF2 Q6Y7W6 1/20 0.48

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
SCHEMBL29617191 0.89 PKM (0.64) PKMFLT1FLT4KDRPRSS1
SCHEMBL17171624 0.82 PKM (0.68) PKMFLT1FLT4KDRPRSS1
SCHEMBL24398126 0.82 PKM (0.44) PKMFLT1FLT4KDRPRSS1
SCHEMBL19017236 0.80 F2 (0.73) PKMPRSS1PRSS2PRSS3TPSAB1
SCHEMBL15216220 0.80 F2 (0.73) PKMPRSS1PRSS2PRSS3TPSAB1
SCHEMBL19751698 0.80 F2 (0.73) PKMPRSS1PRSS2PRSS3TPSAB1
SCHEMBL4968230 0.80 F2 (0.73) PKMPRSS1PRSS2PRSS3TPSAB1
SCHEMBL22420486 0.79 F2 (0.68) PKMPRSS1PRSS2PRSS3TPSAB1
SCHEMBL30574542 0.79 TDP1 (0.71) PKMPRSS1PRSS2PRSS3TPSAB1
SCHEMBL13328289 0.79 PKM (0.69) PKMPRSS1PRSS2PRSS3TPSAB1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20250270253-A1 SITE-SELECTIVE MODIFICATION OF PROTEINS UNIVERSITY OF COPENHAGEN (DK) 2025-08-28 — — US disclosed
EP-4237856-A1 SITE-SELECTIVE MODIFICATION OF PROTEINS Danmarks Tekniske Universitet (DK) 2023-09-06 — — EP disclosed
WO-2022090520-A1 SITE-SELECTIVE MODIFICATION OF PROTEINS DANMARKS TEKNISKE UNIVERSITET (DK) 2022-05-05 — — 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-20250270253-A1 SITE-SELECTIVE MODIFICATION OF PROTEINS PTMS, DNPEP, AADAC PKM 1991/4885FLT1 3153/4885FLT4 2993/4885

“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.

Send feedback