SCHEMBL7370246

SCHEMBL7370246

NC(Cc1ccc(OCc2ccccc2)cc1)C(=O)NCCNCc1ccccc1

nearest known ligand 0.57

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
DPP7 Q9UHL4 1/20 0.57
BCHE P06276 5/20 0.55
LNPEP Q9UIQ6 3/20 0.54
LTA4H P09960 2/20 0.52
REN P00797 1/20 0.52
LAP3 P28838 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
SCHEMBL8179621 0.90 NPC1 (0.56) LNPEPLTA4HRENLAP3
SCHEMBL7698099 0.89 LNPEP (0.59) BCHELNPEPLTA4HLAP3
SCHEMBL21919164 0.86 LTA4H (0.57) LNPEPLTA4HRENLAP3
SCHEMBL7346203 0.83 CTSS (0.53) DPP7REN
SCHEMBL5099006 0.83 PDCD1 (0.65) BCHE
SCHEMBL7375405 0.81 BCHE (0.52) DPP7BCHE
SCHEMBL27386689 0.81 LTA4H (0.65) LNPEPLTA4HLAP3
SCHEMBL7281929 0.80 MMP9 (0.63) LNPEPLTA4HLAP3
SCHEMBL7371156 0.80 HTT (0.57) DPP7LNPEPLTA4H
SCHEMBL3930097 0.80 EPOR (0.57) LNPEPLTA4HRENLAP3

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
US-6117841-A USED TO TREAT STROKE, CEREBRAL ISCHEMIA, PAIN, HEAD TRAUMA OR EPILEPSY WARNER-LAMBERT COMPANY (US) 2000-09-12 US claimed
US-6117841-A USED TO TREAT STROKE, CEREBRAL ISCHEMIA, PAIN, HEAD TRAUMA OR EPILEPSY WARNER-LAMBERT COMPANY (US) 2000-09-12 US disclosed
WO-1998054123-A1 SUBSTITUTED PEPTIDYLAMINE CALCIUM CHANNEL BLOCKERS WARNER-LAMBERT COMPANY (US) 1998-12-03 WO disclosed