SCHEMBL8055091

SCHEMBL8055091

CCN(C(=O)c1ccc(C2(F)CC2c2ccc(Cl)c(Cl)c2)cc1)c1ccccc1C

nearest known ligand 0.53

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.46
NPSR1 Q6W5P4 1/20 0.45
POLB P06746 1/20 0.42
MEN1 O00255 1/20 0.40
KMT2A Q03164 1/20 0.40
GPBAR1 Q8TDU6 1/20 0.39
OPRM1 P35372 1/20 0.36
OPRD1 P41143 1/20 0.36
OPRK1 P41145 1/20 0.36
SLC6A2 P23975 2/20 0.36
SLC6A4 P31645 2/20 0.36
SLC6A3 Q01959 2/20 0.36
CYP3A4 P08684 2/20 0.35
LMNA P02545 1/20 0.35
ALDH1A1 P00352 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
F2 P00734 3/20 0.35

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
SCHEMBL8034314 0.89 NPSR1 (0.47) TSHRNPSR1POLBMEN1KMT2A
SCHEMBL8057747 0.77 LMNA (0.49) POLBMEN1KMT2ALMNAALDH1A1
SCHEMBL8060105 0.76 TSHR (0.35) TSHRNPSR1POLBMEN1KMT2A
SCHEMBL8461900 0.74 TSHR (0.46) TSHRNPSR1MEN1KMT2ASLC6A2
SCHEMBL8055080 0.74 GPBAR1 (0.35) GPBAR1ALDH1A1
SCHEMBL3462834 0.72 NPSR1 (0.67) TSHRNPSR1POLBMEN1KMT2A
SCHEMBL8054861 0.69 SLC16A3 (0.42) MEN1KMT2ACYP3A4LMNAALDH1A1
SCHEMBL7031332 0.69 TSHR (0.47) TSHRNPSR1POLBMEN1KMT2A
SCHEMBL7031329 0.69 TSHR (0.47) TSHRNPSR1POLBMEN1KMT2A
SCHEMBL11670786 0.69 NPSR1 (0.70) TSHRNPSR1POLBMEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-1996022965-A1 NOVEL AROMATIC AMIDES, METHOD FOR PREPARING AND COMPOSITIONS CONTAINING SAME, AND USE THEREOF AS PESTICIDES HOECHST SCHERING AGREVO S.A. (FR) 1996-08-01 WO claimed
US-6013837-A E.G.,4-(2-(3,4,5-TRICHLORO PHENYL) 1-FLUOROCYCLOPROPYL)-N-(2-METHYL PHENYL)BENZAMIDE; PARTICULAR USE AGAINST ARTHROPODS, HELMINTHS AND MOLLUSCS; INSECTICIDES; ACARICIDES; NEMATICIDES; PHOTOSTABILITY; NONTOXIC TO MAMMALS HOECHST MARION ROUSSEL (FR) 2000-01-11 US disclosed
EP-0805795-A1 NOVEL AROMATIC AMIDES, METHOD FOR PREPARING AND COMPOSITIONS CONTAINING SAME, AND USE THEREOF AS PESTICIDES Hoechst Schering AgrEvo S.A. (FR) 1997-11-12 EP disclosed
WO-1996022965-A1 NOVEL AROMATIC AMIDES, METHOD FOR PREPARING AND COMPOSITIONS CONTAINING SAME, AND USE THEREOF AS PESTICIDES HOECHST SCHERING AGREVO S.A. (FR) 1996-08-01 WO disclosed