SCHEMBL15683028

SCHEMBL15683028

CCOC(=O)C(CCCCNC(=O)C(Cc1cnc[nH]1)NC(C)=O)NC(=O)C(Cc1cnc[nH]1)NC(C)=O

nearest known ligand 0.49

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ SLC15A2 Q16348 1/20 0.49
▸ REN P00797 2/20 0.46
▸ MC4R P32245 3/20 0.43
▸ NMBR P28336 2/20 0.41
▸ SCN9A Q15858 1/20 0.41
▸ ACE2 Q9BYF1 1/20 0.41
▸ SIRT6 Q8N6T7 1/20 0.41
▸ SIRT1 Q96EB6 1/20 0.41
▸ HRH3 Q9Y5N1 1/20 0.41
▸ QPCT Q16769 1/20 0.40
▸ QPCTL Q9NXS2 1/20 0.40

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
SCHEMBL15683029 0.88 SLC15A2 (0.63) SLC15A2RENMC4RACE2
SCHEMBL15685572 0.87 SLC15A2 (0.62) SLC15A2RENMC4RACE2
SCHEMBL18994930 0.85 SLC15A2 (0.58) SLC15A2RENMC4RACE2SIRT6
SCHEMBL5810648 0.83 ITGB2 (0.50) RENSCN9AACE2HRH3QPCT
SCHEMBL15683050 0.80 MC4R (0.48) SLC15A2RENMC4R
SCHEMBL15683026 0.79 SLC15A2 (0.47) SLC15A2RENMC4R
SCHEMBL15685547 0.79 SLC15A2 (0.55) SLC15A2RENMC4RACE2
SCHEMBL15683034 0.78 SLC15A2 (0.52) SLC15A2RENMC4RACE2
SCHEMBL12085739 0.76 REN (0.45) SLC15A2RENMC4RSCN9AACE2
SCHEMBL15080458 0.76 REN (0.63) SLC15A2RENMC4RSCN9AACE2

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-9682157-B2 PH-sensitive imaging agents BOARD OF TRUSTEES OF SOUTHERN ILLINOIS UNIVERSITY (US) 2017-06-20 — — US disclosed
US-20140127138-A1 PH-SENSITIVE IMAGING AGENTS BOARD OF TRUSTEES OF SOUTHERN ILLINOIS UNIVERSITY (US) 2014-05-08 — — 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 (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-20140127138-A1 PH-SENSITIVE IMAGING AGENTS PHF6, PHF13, SLC11A2 SLC15A2 2398/4885REN 3957/4885MC4R 4685/4885

“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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