SCHEMBL26003255

SCHEMBL26003255

CC[C@H](C)[C@H](NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H]1CCCN1C(=O)[C@H](C)NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H](N)Cc1ccccc1)C(C)C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CO)C(=O)NCC(=O)NC

nearest known ligand 0.65

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ CALCR P30988 4/20 0.61
▸ OPRD1 P41143 6/20 0.58
▸ TFPI P10646 2/20 0.56
▸ NPY2R P49146 2/20 0.56
▸ NPY4R P50391 2/20 0.56
▸ NPY5R Q15761 2/20 0.56
▸ NPY1R P25929 1/20 0.56

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
SCHEMBL26003156 1.00 CALCR (0.61) CALCROPRD1TFPINPY2RNPY4R
SCHEMBL26003281 0.97 CALCR (0.58) CALCROPRD1TFPI
SCHEMBL30358154 0.90 CALCR (0.64) CALCROPRD1NPY2RNPY4RNPY5R
SCHEMBL29867671 0.89 F2 (0.62) CALCRTFPINPY2RNPY4RNPY5R
SCHEMBL30497011 0.88 OPRD1 (0.67) CALCROPRD1TFPI
SCHEMBL30432005 0.87 CALCR (0.62) CALCRTFPINPY2RNPY4RNPY5R
SCHEMBL29610214 0.87 CALCR (0.62) CALCROPRD1TFPINPY2RNPY4R
SCHEMBL31005079 0.87 TFPI (0.67) CALCROPRD1TFPINPY2RNPY4R
SCHEMBL30262116 0.87 F2 (0.62) CALCROPRD1TFPINPY2RNPY4R
SCHEMBL31182439 0.86 CALCR (0.63) CALCROPRD1NPY2RNPY4RNPY5R

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-20230263800-A1 COMPOSITIONS AND METHODS TO PROMOTE THYMIC FUNCTION FRED HUTCHINSON CANCER CENTER (US) 2023-08-24 — — 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-20230263800-A1 COMPOSITIONS AND METHODS TO PROMOTE THYMIC FUNCTION BMP4, P2RY2, GPR39 CALCR 28/4885OPRD1 2931/4885TFPI 2848/4885

“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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