SCHEMBL8668236

SCHEMBL8668236

CC(=O)NC(Cc1ccc2scccc1-2)C(=O)O

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MME P08473 1/20 0.41
ACE P12821 1/20 0.41
CPA1 P15085 1/20 0.41
ACE2 Q9BYF1 1/20 0.41
KDM4E B2RXH2 3/20 0.41
MAPT P10636 3/20 0.41
ALOX15 P16050 2/20 0.41
THRB P10828 1/20 0.41
NFKB1 P19838 1/20 0.41
PTGS2 P35354 1/20 0.41
THPO P40225 1/20 0.41
RECQL P46063 1/20 0.41
BLM P54132 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
LTA4H P09960 1/20 0.40
TNF P01375 1/20 0.40
LMNA P02545 3/20 0.39
ALDH1A1 P00352 2/20 0.38
GLA P06280 1/20 0.38
GAA P10253 1/20 0.38

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
SCHEMBL8704879 0.78 KDM4E (0.43) MMEACECPA1ACE2KDM4E
SCHEMBL7362447 0.77 CYP2C19 (0.60) KDM4EMAPTALOX15THRBNFKB1
SCHEMBL7362451 0.77 CYP2C19 (0.60) KDM4EMAPTALOX15THRBNFKB1
SCHEMBL8705206 0.77 ALOX15 (0.39) MMEACECPA1ACE2KDM4E
SCHEMBL5327692 0.76 PKM (0.45) KDM4EMAPTALOX15THRBNFKB1
SCHEMBL8704878 0.76 ALOX15 (0.38) MMEACECPA1ACE2KDM4E
SCHEMBL8669916 0.74 ALDH1A1 (0.43) MMEACECPA1ACE2KDM4E
SCHEMBL8668238 0.72 TACR1 (0.43) MMEACECPA1ACE2KDM4E
SCHEMBL9450326 0.70 ALDH1A1 (0.44) KDM4EMAPTNFKB1SMN1; SMN2LTA4H
SCHEMBL8187082 0.70 RAB9A (0.57) KDM4ESMN1; SMN2ALDH1A1GLAGAA

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