SCHEMBL31662849

SCHEMBL31662849

O=C(O)N1C(=O)NCC1c1ccccc1

nearest known ligand 0.44

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
RIPK1 Q13546 9/20 0.44
L3MBTL1 Q9Y468 3/20 0.40
KDM4E B2RXH2 1/20 0.36
HTT P42858 1/20 0.36
ALDH1A1 P00352 1/20 0.36
ALOX15 P16050 1/20 0.36
NPSR1 Q6W5P4 1/20 0.36
PARP3 Q9Y6F1 1/20 0.36

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
SCHEMBL18448056 0.79 RIPK1 (0.49) RIPK1
SCHEMBL4553559 0.73 QPCT (0.51) ALDH1A1NPSR1
SCHEMBL3915731 0.70 ALDH1A1 (0.50) RIPK1HTTALDH1A1NPSR1
SCHEMBL1853020 0.70 GAA (0.47) RIPK1L3MBTL1ALDH1A1
SCHEMBL3915734 0.70 ALDH1A1 (0.50) RIPK1HTTALDH1A1NPSR1
SCHEMBL1419218 0.70 ALDH1A1 (0.49) KDM4EHTTALDH1A1
SCHEMBL11255623 0.69 GAA (0.51) ALDH1A1
SCHEMBL11258889 0.69 GAA (0.51) ALDH1A1
SCHEMBL11255918 0.69 GAA (0.51) ALDH1A1
SCHEMBL11267080 0.69 GAA (0.51) ALDH1A1

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
WO-2025149498-A1 BENZYLPIPERIDINE DERIVATIVES AS TRP4 ANTAGONISTS FOR THE TREATMENT OF INFLAMMATORY DISEASES ASTRAZENECA AB (SE) 2025-07-17 WO disclosed