SCHEMBL7843985

SCHEMBL7843985

CCCCC(=NOC)c1ccc(F)cc1.CON=C(Cc1ccccc1)c1ccc(F)cc1

nearest known ligand 0.47

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
DRD4 P21917 8/20 0.47
DRD2 P14416 4/20 0.47
SLC6A4 P31645 1/20 0.43
HTR7 P34969 1/20 0.42
PPARG P37231 1/20 0.42
PPARA Q07869 1/20 0.42
ALDH1A1 P00352 2/20 0.40
L3MBTL1 Q9Y468 2/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
PTGS1 P23219 1/20 0.36
PTGS2 P35354 1/20 0.36

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
SCHEMBL6814705 0.89 SMN1; SMN2 (0.48) DRD4DRD2PPARGPPARAALDH1A1
SCHEMBL6814945 0.88 HTR7 (0.53) DRD4DRD2SLC6A4HTR7PPARG
SCHEMBL18601776 0.88 HTR7 (0.53) DRD4DRD2SLC6A4HTR7PPARG
SCHEMBL8067420 0.83 DRD4 (0.43) DRD4DRD2PPARGPPARAALDH1A1
SCHEMBL5463394 0.82 PTGS2 (0.49) DRD4DRD2PPARGPPARAPTGS2
SCHEMBL6610239 0.82 PTGS2 (0.49) DRD4DRD2PPARGPPARAPTGS2
SCHEMBL5453693 0.82 PPARA (0.49) DRD4DRD2SLC6A4HTR7PPARG
SCHEMBL5453689 0.82 PPARA (0.49) DRD4DRD2SLC6A4HTR7PPARG
SCHEMBL10040989 0.79 SMN1; SMN2 (0.46) DRD4DRD2ALDH1A1L3MBTL1SMN1; SMN2
SCHEMBL7785539 0.77 CYP1A2 (0.49) DRD4DRD2SLC6A4HTR7PPARG

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
EP-1140913-A1 THIOUREA INHIBITORS OF HERPES VIRUSES AMERICAN HOME PRODUCTS CORPORATION (US) 2001-10-10 EP disclosed
EP-1137647-A1 THIOUREA INHIBITORS OF HERPES VIRUSES AMERICAN HOME PRODUCTS CORPORATION (US) 2001-10-04 EP disclosed
WO-2000034268-A1 THIOUREA INHIBITORS OF HERPES VIRUSES AMERICAN HOME PRODUCTS CORPORATION (US) 2000-06-15 WO disclosed
WO-2000034269-A1 THIOUREA INHIBITORS OF HERPES VIRUSES AMERICAN HOME PRODUCTS CORPORATION (US) 2000-06-15 WO disclosed