SCHEMBL10168694

SCHEMBL10168694

CCCCC[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(C)C)NC(=O)CNC(=O)[C@H](CCC(=O)O)NC(=O)[C@@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCCCN)NC)C(C)CC)C(=O)CN

nearest known ligand 0.59

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ RXFP1 Q9HBX9 9/20 0.59
▸ FURIN P09958 2/20 0.46
▸ PRSS1 P07477 1/20 0.46
▸ TFPI P10646 1/20 0.46
▸ GRIN2D O15399 1/20 0.46
▸ GRIN3B O60391 1/20 0.46
▸ GRIN1 Q05586 1/20 0.46
▸ GRIN2A Q12879 1/20 0.46
▸ GRIN2B Q13224 1/20 0.46
▸ GRIN2C Q14957 1/20 0.46
▸ GRIN3A Q8TCU5 1/20 0.46
▸ PTH1R Q03431 1/20 0.42
▸ F2 P00734 1/20 0.42
▸ KRAS P01116 2/20 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
SCHEMBL10168630 0.92 RXFP1 (0.54) RXFP1TFPIGRIN2DGRIN3BGRIN1
SCHEMBL10168809 0.87 RXFP1 (0.59) RXFP1FURINTFPIGRIN2DGRIN3B
SCHEMBL10169113 0.87 RXFP1 (0.59) RXFP1FURINTFPIGRIN2DGRIN3B
SCHEMBL10168283 0.87 RXFP1 (0.59) RXFP1FURINTFPIGRIN2DGRIN3B
SCHEMBL16299147 0.87 RXFP1 (0.56) RXFP1TFPIGRIN2DGRIN3BGRIN1
SCHEMBL10168791 0.86 RXFP1 (0.57) RXFP1TFPIGRIN2DGRIN3BGRIN1
SCHEMBL10168608 0.86 RXFP1 (0.57) RXFP1TFPIGRIN2DGRIN3BGRIN1
SCHEMBL10168790 0.86 RXFP1 (0.57) RXFP1TFPIGRIN2DGRIN3BGRIN1
SCHEMBL10168584 0.86 RXFP1 (0.60) RXFP1FURINTFPIGRIN2DGRIN3B
SCHEMBL10168624 0.86 RXFP1 (0.57) RXFP1TFPIGRIN2DGRIN3BGRIN1

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-20120028888-A1 APJ RECEPTOR COMPOUNDS ANCHOR THERAPEUTICS, INC. 2012-02-02 — — 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-20120028888-A1 APJ RECEPTOR COMPOUNDS APLNR, AP1G1, AP2B1 RXFP1 827/4885FURIN 2274/4885PRSS1 4113/4885

“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