SCHEMBL30463263

SCHEMBL30463263

CSCC[C@@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)NC(C)=O)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](C)C(N)=O

nearest known ligand 0.43

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
RXFP1 Q9HBX9 2/20 0.43
NPY5R Q15761 3/20 0.42
SIRT5 Q9NXA8 3/20 0.42
NPY1R P25929 2/20 0.42
NPY4R P50391 2/20 0.42
BACE1 P56817 3/20 0.41
SIRT2 Q8IXJ6 1/20 0.41
CTSL P07711 3/20 0.41
CTSS P25774 3/20 0.41
CTSK P43235 3/20 0.41
CTSH P09668 1/20 0.41
IL23R Q5VWK5 3/20 0.40
TFPI P10646 1/20 0.40
BACE2 Q9Y5Z0 1/20 0.39

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
SCHEMBL30463254 1.00 RXFP1 (0.43) RXFP1NPY5RSIRT5NPY1RNPY4R
SCHEMBL31036875 0.96 SIRT5 (0.46) RXFP1NPY5RSIRT5NPY1RNPY4R
SCHEMBL12066142 0.96 SIRT5 (0.46) RXFP1NPY5RSIRT5NPY1RNPY4R
SCHEMBL31157630 0.94 SIRT5 (0.48) RXFP1NPY5RSIRT5NPY1RNPY4R
SCHEMBL31157658 0.94 SIRT5 (0.48) RXFP1NPY5RSIRT5NPY1RNPY4R
SCHEMBL31157655 0.94 SIRT5 (0.43) RXFP1NPY5RSIRT5NPY1RNPY4R
SCHEMBL31157643 0.93 SIRT5 (0.48) RXFP1NPY5RSIRT5NPY1RNPY4R
SCHEMBL31157701 0.93 BACE1 (0.45) RXFP1NPY5RSIRT5NPY1RNPY4R
SCHEMBL31157696 0.92 IL23R (0.45) RXFP1NPY5RSIRT5NPY1RNPY4R
SCHEMBL3739792 0.92 IL23R (0.45) RXFP1NPY5RSIRT5NPY1RNPY4R

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-20230190616-A1 COMPOUNDS USEFUL FOR THE TREATMENT AND/OR CARE OF THE SKIN, HAIR, NAILS AND/OR MUCOUS MEMBRANES LUBRIZOL ADVANCED MATERIALS, INC. (US) 2023-06-22 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-20230190616-A1 COMPOUNDS USEFUL FOR THE TREATMENT AND/OR CARE OF THE SKIN, HAIR, NAILS AND/OR MUCOUS MEMBRANES GLA, ALG3, ANXA6 RXFP1 224/4885NPY5R 247/4885SIRT5 3611/4885

“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.