SCHEMBL7598437

SCHEMBL7598437

C[C@H](c1ccc(OCc2ccccc2)cc1)N(C(=O)C(c1ccccc1)c1ccccc1)[C@H](CCCN)C(N)=O

nearest known ligand 0.55

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 2/20 0.55
EPOR P19235 3/20 0.50
LTA4H P09960 2/20 0.44
NPY5R Q15761 1/20 0.42
ACACB O00763 1/20 0.42

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
SCHEMBL7595296 0.88 ALDH1A1 (0.44) ALOX5
Hydrochloric Acid SCHEMBL7600447 0.88 ALOX5 (0.42) ALOX5EPORNPY5R
SCHEMBL7597931 0.88 ALDH1A1 (0.44) ALOX5
SCHEMBL7600674 0.87 TRPM8 (0.46) ALOX5
SCHEMBL7596920 0.87 ALOX5 (0.50) ALOX5EPORNPY5RACACB
Hydrochloric Acid SCHEMBL7600168 0.87 ALDH1A1 (0.46) ALOX5
SCHEMBL7600461 0.86 GPR88 (0.46) ALOX5ACACB
SCHEMBL7596331 0.86 TRPM8 (0.41) ALOX5NPY5R
SCHEMBL7598850 0.86 ALOX5 (0.49) ALOX5EPOR
Hydrochloric Acid SCHEMBL7594995 0.86 TRPM8 (0.45) ALOX5

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1017672-B1 NEW NPY ANTAGONISTS ASTRAZENECA AB (SE) 2002-11-27 EP disclosed
EP-1017672-A1 NEW NPY ANTAGONISTS AstraZeneca AB (SE) 2000-07-12 EP disclosed
WO-1999015498-A1 NEW NPY ANTAGONISTS ASTRAZENECA AB (SE) 1999-04-01 WO disclosed