SCHEMBL7803457

SCHEMBL7803457

Cc1c(Cc2ccccc2)ccc(OCC2COC(c3c(F)cccc3F)=N2)c1C

nearest known ligand 0.45

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
TAAR1 Q96RJ0 3/20 0.34
MAPT P10636 2/20 0.34
NPC1 O15118 1/20 0.34
POLB P06746 1/20 0.34
RAB9A P51151 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
HRH3 Q9Y5N1 1/20 0.34
KDM1A O60341 2/20 0.33
HTR1A P08908 1/20 0.32
SLC6A2 P23975 1/20 0.32
SLC6A4 P31645 1/20 0.32
SLC6A3 Q01959 1/20 0.32
CYP2D6 P10635 1/20 0.32
ALDH1A1 P00352 1/20 0.32

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
SCHEMBL7803379 0.84 HRH3 (0.38) TAAR1MAPTNPC1POLBRAB9A
SCHEMBL7809022 0.82 TAAR1 (0.31) TAAR1CYP2D6
SCHEMBL7803592 0.79 LTA4H (0.41) TAAR1MAPTNPC1POLBRAB9A
SCHEMBL7812242 0.76 TAAR1 (0.46) TAAR1
SCHEMBL7808755 0.75 TAAR1 (0.47) TAAR1KDM1ASLC6A2SLC6A3
SCHEMBL7812253 0.73 TAAR1 (0.38) TAAR1MAPTNPC1POLBRAB9A
SCHEMBL7812313 0.72 TAAR1 (0.40) TAAR1MAPTNPC1POLBRAB9A
SCHEMBL7803372 0.72 TAAR1 (0.43) TAAR1
SCHEMBL7803444 0.71 TAAR1 (0.36) TAAR1
SCHEMBL7808450 0.71 TAAR1 (0.33) TAAR1

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-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
US-5411979-A Insecticides, miticides SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1995-05-02 US disclosed
EP-0553623-A1 An oxazoline derivative its production and its use SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1993-08-04 EP disclosed