SCHEMBL7962013

SCHEMBL7962013

CC(Cc1c(F)cccc1Cl)=NO

nearest known ligand 0.50

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
GAA P10253 1/20 0.50
TAAR1 Q96RJ0 1/20 0.49
SMN1; SMN2 Q16637 3/20 0.48
MAPT P10636 2/20 0.48
KMT2A Q03164 1/20 0.48
NPC1 O15118 2/20 0.45
RAB9A P51151 2/20 0.45
KDM4E B2RXH2 2/20 0.44
TP53 P04637 2/20 0.44
BACE1 P56817 1/20 0.44
ALDH1A1 P00352 2/20 0.44
POLB P06746 3/20 0.43

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
SCHEMBL6022786 0.79 TAAR1 (0.53) GAATAAR1SMN1; SMN2MAPTKMT2A
SCHEMBL21729216 0.79 TAAR1 (0.53) GAATAAR1SMN1; SMN2MAPTKMT2A
SCHEMBL4532658 0.79 MAPT (0.58) GAATAAR1SMN1; SMN2MAPTKMT2A
SCHEMBL9729592 0.76 SMN1; SMN2 (0.58) GAATAAR1SMN1; SMN2MAPTKMT2A
SCHEMBL28483649 0.73 TDP1 (0.40) SMN1; SMN2MAPTKMT2ANPC1RAB9A
SCHEMBL28596017 0.73 TAAR1 (0.63) GAATAAR1SMN1; SMN2MAPTKMT2A
SCHEMBL1285811 0.73 AKR1B1 (0.74) GAATAAR1SMN1; SMN2MAPTKMT2A
SCHEMBL29570152 0.73 AKR1B1 (0.74) GAATAAR1SMN1; SMN2MAPTKMT2A
SCHEMBL1885453 0.73 MAPT (0.59) GAATAAR1SMN1; SMN2MAPTKMT2A
SCHEMBL13069539 0.72 SMN1; SMN2 (0.43) SMN1; SMN2MAPTKMT2ANPC1RAB9A

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
US-6268310-B1 CONTROLLING WEEDS NIPPON SODA CO., LTD. (JP) 2001-07-31 US disclosed
US-6107251-A SUCH AS 5-(2-(4,6-DIMETHOXYPYRIMIDINE-2-YLOXY)-6-(4,6-DIMETHOXYTRIAZINE-2 -YLOXY)PHENYL)OXAZOLE AND OTHER COMPOUNDS OF SPECIFIED FORMULA NIPPON SODA CO., LTD. (JP) 2000-08-22 US disclosed
US-5962685-A HERBICIDES NIPPON SODA CO., LTD. (JP) 1999-10-05 US disclosed