SCHEMBL20764559

SCHEMBL20764559

NCCCCC(N)C(=O)NC(CC(=O)O)C(=O)NC(CO)C(=O)NC(CO)C(=O)N1CCCC1C(=O)N1CCCC1C(=O)N1CCCC1C(=O)N1CCCC1C(=O)NC(CS)C(=O)O

nearest known ligand 0.52

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ OPRM1 P35372 3/20 0.52
▸ CAPN1 P07384 3/20 0.44
▸ BDKRB2 P30411 1/20 0.44
▸ GRB2 P62993 1/20 0.42
▸ F2 P00734 1/20 0.42
▸ NTSR2 O95665 5/20 0.41
▸ NTSR1 P30989 5/20 0.41
▸ SORT1 Q99523 3/20 0.41
▸ OPRD1 P41143 2/20 0.40
▸ NRP1 O14786 1/20 0.40
▸ CXCR4 P61073 2/20 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
SCHEMBL30069733 0.90 OPRM1 (0.54) OPRM1GRB2F2NTSR2NTSR1
SCHEMBL30286828 0.87 OPRM1 (0.52) OPRM1GRB2F2NTSR2NTSR1
SCHEMBL30080797 0.86 OPRM1 (0.51) OPRM1GRB2F2NTSR2NTSR1
SCHEMBL29471807 0.86 OPRM1 (0.51) OPRM1CAPN1BDKRB2GRB2F2
SCHEMBL29591635 0.86 OPRM1 (0.52) OPRM1BDKRB2GRB2F2NTSR2
SCHEMBL29590494 0.85 OPRM1 (0.51) OPRM1BDKRB2GRB2F2NTSR2
SCHEMBL29630459 0.85 OPRM1 (0.53) OPRM1BDKRB2F2NTSR2NTSR1
SCHEMBL29881564 0.84 OPRM1 (0.59) OPRM1CAPN1BDKRB2GRB2F2
SCHEMBL29886892 0.84 OPRM1 (0.47) OPRM1CAPN1OPRD1
SCHEMBL29380256 0.84 OPRM1 (0.46) OPRM1F2NTSR2NTSR1OPRD1

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
EP-3672626-A1 COMPOSITION OF TUMOR-ASSOCIATED PROLIFERATIVE PEPTIDES AND RELATED ANTI-CANCER IMMUNOGEN FOR THE TREATMENT OF LUNG CANCERS AND OTHER CANCERS Onkologix Ltd (US) 2020-07-01 — — EP disclosed
WO-2019038671-A1 COMPOSITION OF TUMOR-ASSOCIATED PROLIFERATIVE PEPTIDES AND RELATED ANTI-CANCER IMMUNOGEN FOR THE TREATMENT OF LUNG CANCERS AND OTHER CANCERS ONKOLOGIX LTD (US) 2019-02-28 — — WO disclosed
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