SCHEMBL26015644

SCHEMBL26015644

CNCCCC[C@H](NC(=O)[C@@H](N)Cc1ccccc1)C(=O)Nc1ccc(C(O)C(=O)OC)cc1

nearest known ligand 0.47

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
SSTR3 P32745 1/20 0.47
OPRK1 P41145 3/20 0.46
SIRT2 Q8IXJ6 8/20 0.45
SIRT1 Q96EB6 8/20 0.45
SIRT3 Q9NTG7 3/20 0.45
SIRT5 Q9NXA8 2/20 0.44
REN P00797 1/20 0.42
EED O75530 1/20 0.42

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
SCHEMBL26024799 0.93 SSTR3 (0.47) SSTR3OPRK1SIRT2SIRT1SIRT3
SCHEMBL26025959 0.85 OPRK1 (0.49) SSTR3OPRK1SIRT2SIRT1SIRT3
SCHEMBL29649537 0.85 SSTR3 (0.42) SSTR3OPRK1SIRT2SIRT1SIRT3
SCHEMBL26015648 0.81 PTPN1 (0.44) SSTR3SIRT2SIRT1SIRT3SIRT5
SCHEMBL26015649 0.81 SPHK1 (0.45)
SCHEMBL19479881 0.79 OPRK1 (0.45) OPRK1SIRT2SIRT1SIRT3SIRT5
SCHEMBL26015583 0.78 SIRT2 (0.45) OPRK1SIRT2SIRT1SIRT3SIRT5
Hydrochloric Acid SCHEMBL6290469 0.77 LTA4H (0.51) SSTR3OPRK1
SCHEMBL26015651 0.77 TLR2 (0.44) SIRT2SIRT1SIRT3SIRT5
SCHEMBL8515919 0.76 OPRD1 (0.40) SSTR3OPRK1SIRT1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230241243-A1 CARRIER PARTICLE-DRUG CONJUGATES, SELF-IMMOLATIVE LINKERS, AND USES THEREOF ELUCIDA ONCOLOGY, INC. 2023-08-03 US 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-20230241243-A1 CARRIER PARTICLE-DRUG CONJUGATES, SELF-IMMOLATIVE LINKERS, AND USES THEREOF NDC1, KIFC1, SDCBP SSTR3 3591/4885OPRK1 4393/4885SIRT2 2798/4885

“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.