SCHEMBL19929558

SCHEMBL19929558

C[C@@H](CCCCNC(=S)CCc1ccc([123I])cc1)C(=O)O

nearest known ligand 0.40

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
SIRT2 Q8IXJ6 6/20 0.40
SIRT1 Q96EB6 6/20 0.40
ALB P02768 2/20 0.39
HPGD P15428 2/20 0.39
KMT2A Q03164 2/20 0.38
ALDH1A1 P00352 1/20 0.38
SIRT3 Q9NTG7 1/20 0.37
CYP2D6 P10635 1/20 0.37
CYP2C9 P11712 1/20 0.37
CYP2C19 P33261 1/20 0.37
LMNA P02545 1/20 0.37
PKM P14618 1/20 0.37
LTB4R Q15722 3/20 0.37
ITGB3 P05106 1/20 0.36
ITGA2B P08514 1/20 0.36
POLB P06746 1/20 0.36

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
SCHEMBL19929568 0.94 ALB (0.43) SIRT2SIRT1ALBHPGDKMT2A
SCHEMBL19929560 0.88 SIRT2 (0.40) SIRT2SIRT1ALBHPGDKMT2A
SCHEMBL19929563 0.88 SIRT2 (0.40) SIRT2SIRT1ALBHPGDKMT2A
SCHEMBL19929564 0.88 FOLH1 (0.41) SIRT2SIRT1ALBHPGDKMT2A
SCHEMBL24193241 0.88 ALB (0.52) SIRT2SIRT1ALB
SCHEMBL19929566 0.88 HPGD (0.52) ALBHPGDKMT2AALDH1A1LMNA
SCHEMBL19929581 0.85 CA12 (0.39) SIRT2SIRT1ALBHPGD
SCHEMBL19929573 0.84 ALB (0.56) ALBHPGDKMT2AALDH1A1LMNA
SCHEMBL19929569 0.82 ALB (0.43) SIRT2SIRT1ALBHPGDKMT2A
SCHEMBL19929572 0.82 ALB (0.43) SIRT2SIRT1ALBHPGDKMT2A

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-20230332199-A1 FUNCTIONALLY MODIFIED POLYPEPTIDES AND RADIOBIOSYNTHESIS RATIO THERAPEUTICS, INC. 2023-10-19 US disclosed
US-20180066298-A1 FUNCTIONALLY MODIFIED POLYPEPTIDES AND RADIOBIOSYNTHESIS RATIO THERAPEUTICS, INC. 2018-03-08 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 (2 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-20230332199-A1 FUNCTIONALLY MODIFIED POLYPEPTIDES AND RADIOBIOSYNTHESIS IL1RN, IL2RA, IL1A SIRT2 2885/4885SIRT1 2138/4885ALB 31/4885
US-20180066298-A1 FUNCTIONALLY MODIFIED POLYPEPTIDES AND RADIOBIOSYNTHESIS IL1RN, IL2RA, IL1A SIRT2 2885/4885SIRT1 2138/4885ALB 31/4885

“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.