SCHEMBL25814254

SCHEMBL25814254

C=CCC(=O)NCCCc1occc1OC

nearest known ligand 0.42

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
MTNR1A P48039 5/20 0.42
MTNR1B P49286 5/20 0.42
NQO2 P16083 1/20 0.42
MEN1 O00255 2/20 0.37
KMT2A Q03164 2/20 0.37

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
SCHEMBL22184129 0.84 MTNR1A (0.50) MTNR1AMTNR1BMEN1KMT2A
SCHEMBL22184151 0.84 MTNR1A (0.42) MTNR1AMTNR1BMEN1KMT2A
SCHEMBL22184132 0.83 MTNR1A (0.44) MTNR1AMTNR1BMEN1KMT2A
SCHEMBL22184085 0.79 POLB (0.41)
SCHEMBL25816016 0.78 BCHE (0.37)
SCHEMBL22184128 0.76 POLB (0.39)
SCHEMBL20570535 0.72 HPGD (0.46) KMT2A
SCHEMBL20570855 0.70 RXFP1 (0.41)
SCHEMBL23948510 0.68 TNKS2 (0.37) MEN1KMT2A
SCHEMBL17457447 0.68 TSHR (0.37) MTNR1AMTNR1BNQO2MEN1KMT2A

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-4223319-A2 METHOD AND MOLECULES MedImmune, LLC (US) 2023-08-09 EP disclosed
EP-3630732-B1 METHOD AND MOLECULES MEDIMMUNE LLC (US) 2023-07-12 EP disclosed