SCHEMBL7808755

SCHEMBL7808755

Fc1cccc(F)c1C1=NC(COc2ccc(OCc3ccccc3)cc2)CO1

nearest known ligand 0.50

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
TAAR1 Q96RJ0 3/20 0.47
KDM1A O60341 2/20 0.40
MAOB P27338 2/20 0.40
LMNA P02545 1/20 0.39
CYP1A2 P05177 1/20 0.39
PTGS1 P23219 1/20 0.39
SLC6A2 P23975 1/20 0.39
CYP2C19 P33261 1/20 0.39
PTGS2 P35354 1/20 0.39
SLC6A3 Q01959 1/20 0.39
HIF1A Q16665 1/20 0.39
HDAC6 Q9UBN7 1/20 0.39

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
SCHEMBL7803592 0.91 LTA4H (0.41) TAAR1
SCHEMBL7812242 0.90 TAAR1 (0.46) TAAR1
SCHEMBL7812632 0.90 NPC1 (0.40) TAAR1MAOB
SCHEMBL7809030 0.90 TAAR1 (0.46) TAAR1MAOB
SCHEMBL7809985 0.90 MAOB (0.42) TAAR1MAOB
SCHEMBL8892399 0.89 TAAR1 (0.54) TAAR1
SCHEMBL7803372 0.88 TAAR1 (0.43) TAAR1
SCHEMBL7812313 0.88 TAAR1 (0.40) TAAR1
SCHEMBL7810243 0.88 MRGPRX4 (0.38) TAAR1
SCHEMBL7803673 0.84 TAAR1 (0.41) TAAR1LMNA

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
EP-0553623-B1 An oxazoline derivative its production and its use SUMITOMO CHEMICAL CO (JP) 2001-04-04 EP disclosed
US-5556867-A INSECTICIDES AND MITICIDES SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1996-09-17 US disclosed
EP-0553623-A1 An oxazoline derivative its production and its use SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1993-08-04 EP disclosed