SCHEMBL16961968

SCHEMBL16961968

CCOc1ccc(OC(F)(F)F)cc1CO

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TACR1 P25103 1/20 0.46
L3MBTL1 Q9Y468 2/20 0.44
KCNB1 Q14721 1/20 0.43
CNR1 P21554 1/20 0.42
S1PR1 P21453 1/20 0.42
RUNX1 Q01196 1/20 0.40
FFAR4 Q5NUL3 1/20 0.39
MTNR1A P48039 1/20 0.39
MTNR1B P49286 1/20 0.39
GRM7 Q14831 1/20 0.39
USP28 Q96RU2 1/20 0.38
USP25 Q9UHP3 1/20 0.38
F2RL3 Q96RI0 1/20 0.38
SLC6A2 P23975 2/20 0.38
SLC6A4 P31645 2/20 0.38
POLB P06746 1/20 0.38
LMNA P02545 1/20 0.38
MAPT P10636 1/20 0.38
ATM Q13315 1/20 0.38
PPARD Q03181 1/20 0.37

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
SCHEMBL16957460 0.88 L3MBTL1 (0.44) TACR1L3MBTL1KCNB1RUNX1SLC6A2
SCHEMBL16952941 0.85 GPR3 (0.42) RUNX1FFAR4USP28USP25SLC6A2
SCHEMBL4638450 0.84 GRIN2B (0.46) TACR1FFAR4HCRTR1HCRTR2
SCHEMBL15054725 0.84 FOS (0.41) TACR1KCNB1RUNX1FFAR4USP28
SCHEMBL30072284 0.83 KDM4E (0.49) MTNR1AMTNR1B
SCHEMBL3742706 0.83 KDM4E (0.49) MTNR1AMTNR1B
SCHEMBL16950704 0.80 MTNR1A (0.56) MTNR1AMTNR1BLMNAMAPTATM
SCHEMBL16958409 0.80 TACR1 (0.47) TACR1KCNB1RUNX1FFAR4GRM7
SCHEMBL1587678 0.80 USP28 (0.50) FFAR4MTNR1AMTNR1BUSP28USP25
SCHEMBL6482510 0.79 TACR1 (0.48) TACR1RUNX1FFAR4SLC6A4

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2900645-A1 3-PHENYLISOXAZOLIN DERIVATIVES WITH HERBICIDAL ACTION Bayer CropScience AG (DE) 2015-08-05 EP disclosed