SCHEMBL8518685

SCHEMBL8518685

O=C(Nc1ccccc1)Nc1ccccc1C=Cc1ccccc1

nearest known ligand 0.75

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SNCA P37840 6/20 0.75
TP53 P04637 1/20 0.55
EPHX1 P07099 1/20 0.55
TSHR P16473 1/20 0.55
EPHX2 P34913 1/20 0.55
CDK9 P50750 1/20 0.55
SMN1; SMN2 Q16637 1/20 0.55
CLK4 Q9HAZ1 1/20 0.55
MEN1 O00255 5/20 0.54
KMT2A Q03164 5/20 0.54
LMNA P02545 2/20 0.54
NPC1 O15118 2/20 0.54
RAB9A P51151 2/20 0.54
HTT P42858 1/20 0.54
MAOB P27338 3/20 0.51
EGFR P00533 1/20 0.51
MMP1 P03956 1/20 0.51
MMP2 P08253 1/20 0.51
MMP9 P14780 1/20 0.51
MAOA P21397 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
SCHEMBL3154767 0.83 SNCA (0.65) SNCAEPHX2NPC1RAB9A
SCHEMBL3154762 0.83 SNCA (0.65) SNCAEPHX2NPC1RAB9A
SCHEMBL11996395 0.83 SMN1; SMN2 (0.68) SNCATP53EPHX1TSHREPHX2
SCHEMBL11996396 0.83 SMN1; SMN2 (0.68) SNCATP53EPHX1TSHREPHX2
SCHEMBL11038552 0.80 SNCA (0.64) SNCAMEN1KMT2ANPC1RAB9A
SCHEMBL11038549 0.80 SNCA (0.64) SNCAMEN1KMT2ANPC1RAB9A
SCHEMBL10006565 0.80 SNCA (0.56) SNCAKDM4EMAPTPOLB
SCHEMBL10006568 0.80 SNCA (0.56) SNCAKDM4EMAPTPOLB
SCHEMBL21082016 0.79 MMP1 (0.73) NPC1RAB9AMAOBEGFRMMP1
SCHEMBL19501046 0.79 MMP1 (0.73) NPC1RAB9AMAOBEGFRMMP1

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-5879674-A SIMPLE SELF-AGGLOMERATION OF COAL FINES HEATED TO AT LEAST 600 DEGREES CELCIUS FOR AT LEAST 5 MINUTES AMERICAN CYANAMID COMPANY (US) 1999-03-09 US disclosed
EP-0568731-A1 Methods and compositions containing pesticides and stilbene compounds for enhanced pesticidal activity AMERICAN CYANAMID COMPANY (US) 1993-11-10 EP disclosed
US-5246936-A Methods and compositions containing pesticides and stilbene compounds for enhanced pesticidal activity AMERICAN CYANAMID COMPANY (US) 1993-09-21 US disclosed