SCHEMBL4795033

SCHEMBL4795033

COCCOC1CC(=O)c2ccccc2C1=O

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
S100A4 P26447 1/20 0.45
TSHR P16473 1/20 0.37
MAPT P10636 3/20 0.35
TP53 P04637 2/20 0.35
NPC1 O15118 2/20 0.35
RAB9A P51151 2/20 0.35
SMN1; SMN2 Q16637 2/20 0.35
HPGD P15428 1/20 0.35
MAOA P21397 1/20 0.35
PTGS2 P35354 1/20 0.35
MAP2K7 O14733 1/20 0.35
CDC25A P30304 1/20 0.35
CDC25B P30305 1/20 0.35
CNR2 P34972 1/20 0.34
LMNA P02545 3/20 0.34
CYP1A2 P05177 1/20 0.34
CYP3A4 P08684 1/20 0.34
MAPK1 P28482 1/20 0.34
HTR2B P41595 1/20 0.34
ACHE P22303 2/20 0.34

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
SCHEMBL5319357 0.85 S100A4 (0.42) S100A4TSHRMAPTTP53HPGD
SCHEMBL10079528 0.80 S100A4 (0.53) S100A4MAPTTP53NPC1RAB9A
SCHEMBL23792505 0.72 S100A4 (0.49) S100A4MAPTTP53NPC1RAB9A
SCHEMBL16377312 0.71 S100A4 (0.55) S100A4MAPTTP53HPGDLMNA
SCHEMBL9740101 0.70 ACHE (0.50) TSHRMAPTHTR2BACHEKDM4E
SCHEMBL5027063 0.69 S100A4 (0.45) S100A4TSHRMAPTTP53LMNA
SCHEMBL30628557 0.68 LMNA (0.39) TSHRMAPTTP53NPC1SMN1; SMN2
SCHEMBL827598 0.67 S100A4 (0.40) S100A4TSHRMAPTNPC1RAB9A
SCHEMBL1093630 0.67 S100A4 (0.42) S100A4TSHRMAPTTP53SMN1; SMN2
SCHEMBL66876 0.66 ACHE (0.64) S100A4TSHRMAPTTP53LMNA

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-7378373-B2 Color former, developer, binder resin, and plasticizer; improved performance KABUSHIKI KAISHA TOSHIBA (JP) 2008-05-27 US disclosed
US-20070072771-A1 ERASABLE IMAGE FORMING MATERIAL KABUSHIKI KAISHA TOSHIBA (JP) 2007-03-29 US disclosed