SCHEMBL9800511

SCHEMBL9800511

N[C@@H](Cc1ccccc1)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CC1CCCCC1)[C@@H](O)[C@@H](O)C1CC1

nearest known ligand 0.55

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
REN P00797 19/20 0.55
P2RX1 P51575 1/20 0.51

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
SCHEMBL8909157 1.00 REN (0.55) RENP2RX1
SCHEMBL8909404 0.93 REN (0.62) RENP2RX1
SCHEMBL7303652 0.91 REN (0.57) REN
SCHEMBL9692950 0.90 REN (0.58) REN
SCHEMBL9800781 0.90 REN (0.55) RENP2RX1
Hydrochloric Acid SCHEMBL9800528 0.89 REN (0.52) RENP2RX1
SCHEMBL9800778 0.89 REN (0.55) RENP2RX1
SCHEMBL7277076 0.89 P2RX1 (0.46) RENP2RX1
SCHEMBL7290665 0.89 P2RX1 (0.46) RENP2RX1
SCHEMBL7433840 0.89 P2RX1 (0.46) RENP2RX1

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
EP-0416373-A2 Amino acid derivatives F. HOFFMANN-LA ROCHE AG (CH) 1991-03-13 EP disclosed