SCHEMBL2290959

SCHEMBL2290959

C#CCOc1c(F)cc(C(=O)NC(C)C(C)C)c(F)c1F

nearest known ligand 0.39

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
TAS1R3 Q7RTX0 2/20 0.37
TAS1R1 Q7RTX1 2/20 0.37
TAS1R2 Q8TE23 2/20 0.37
KAT6A Q92794 1/20 0.34
CNR2 P34972 1/20 0.33
P2RX3 P56373 4/20 0.32
P2RX2 Q9UBL9 4/20 0.32
TRPV1 Q8NER1 1/20 0.32
HTR2A P28223 1/20 0.32
LMNA P02545 2/20 0.31
MAPT P10636 1/20 0.30
HPGD P15428 1/20 0.30
SMN1; SMN2 Q16637 1/20 0.30
SCN9A Q15858 1/20 0.30

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
SCHEMBL3304686 0.84 CYP2C9 (0.39) TAS1R3TAS1R1TAS1R2P2RX3P2RX2
SCHEMBL3306956 0.84 CYP2C9 (0.39) TAS1R3TAS1R1TAS1R2P2RX3P2RX2
SCHEMBL2290252 0.82 DHODH (0.38) LMNAHPGDSMN1; SMN2
SCHEMBL2287013 0.81 SCN9A (0.39) TAS1R3TAS1R1TAS1R2KAT6ACNR2
SCHEMBL2292359 0.81 DHODH (0.41) TAS1R3TAS1R1CNR2LMNAHPGD
SCHEMBL3288244 0.80 MAPK1 (0.46) TAS1R3TAS1R1LMNA
SCHEMBL13325364 0.80 MAPK1 (0.46) TAS1R3TAS1R1LMNA
SCHEMBL3309608 0.80 MAPK1 (0.46) TAS1R3TAS1R1LMNA
SCHEMBL14530741 0.80 CYP2C9 (0.41) TAS1R3TAS1R1TAS1R2P2RX3P2RX2
SCHEMBL2294976 0.77 NPC1 (0.37) KAT6ASCN9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7999136-B2 Amide compound and use thereof SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2011-08-16 US disclosed
US-7999136-B2 Amide compound and use thereof SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2011-08-16 US disclosed
US-7999136-B2 Amide compound and use thereof SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2011-08-16 US disclosed
US-20100056640-A1 AMIDE COMPOUND AND USE THEREOF SUMITOMO CHEMICAL COMPANY LIMITED (JP) 2010-03-04 US disclosed
US-20100056640-A1 AMIDE COMPOUND AND USE THEREOF SUMITOMO CHEMICAL COMPANY LIMITED (JP) 2010-03-04 US disclosed
US-20100056640-A1 AMIDE COMPOUND AND USE THEREOF SUMITOMO CHEMICAL COMPANY LIMITED (JP) 2010-03-04 US disclosed
EP-2143709-A1 AMIDE COMPOUND AND USE THEREOF Sumitomo Chemical Company, Limited (JP) 2010-01-13 EP disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20100056640-A1 AMIDE COMPOUND AND USE THEREOF NAT1, AGXT, HAX1 TAS1R3 2389/4885TAS1R1 2324/4885TAS1R2 2976/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.