SCHEMBL8668232

SCHEMBL8668232

CCCCC(=O)NC(Cc1cccc2ccccc12)C(=O)O

nearest known ligand 0.63

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
MME P08473 2/20 0.59
ACE P12821 2/20 0.59
CPA1 P15085 1/20 0.59
ACE2 Q9BYF1 1/20 0.59
HRH4 Q9H3N8 1/20 0.54
FAAH O00519 2/20 0.52
MMP9 P14780 2/20 0.49
PIN1 Q13526 1/20 0.48
MMP8 P22894 1/20 0.48
MMP14 P50281 1/20 0.48
TACR1 P25103 1/20 0.47
CTNNB1 P35222 1/20 0.47
FOLH1 Q04609 1/20 0.47

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
SCHEMBL3660997 1.00 MME (0.59) MMEACECPA1ACE2HRH4
SCHEMBL3658383 0.96 MME (0.58) MMEACECPA1ACE2HRH4
SCHEMBL8673998 0.96 MME (0.58) MMEACECPA1ACE2HRH4
SCHEMBL3658631 0.95 FAAH (0.58) MMEACECPA1ACE2HRH4
SCHEMBL21772500 0.95 FAAH (0.58) MMEACECPA1ACE2HRH4
SCHEMBL3658643 0.95 FAAH (0.58) MMEACECPA1ACE2HRH4
SCHEMBL3662267 0.95 FAAH (0.58) MMEACECPA1ACE2HRH4
SCHEMBL3660631 0.95 FAAH (0.58) MMEACECPA1ACE2HRH4
SCHEMBL3663736 0.95 FAAH (0.58) MMEACECPA1ACE2HRH4
SCHEMBL3660699 0.95 FAAH (0.58) MMEACECPA1ACE2HRH4

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
US-5849781-A Tricyclic amides ADIR ET COMPAGNIE (FR) 1998-12-15 US disclosed
US-5712312-A MELATONINERGIC RECEPTOR LIGANDS, TREATMENT OF SLEEP DISORDERS ADIR ET COMPAGNIE (FR) 1998-01-27 US disclosed