SCHEMBL2295871

SCHEMBL2295871

C#CCOc1cc(F)c(C(=O)NC2CCCCC2Cl)cc1F

nearest known ligand 0.40

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
SCN9A Q15858 18/20 0.40
NPC1 O15118 1/20 0.37
RAB9A P51151 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
TAS1R3 Q7RTX0 1/20 0.35
TAS1R1 Q7RTX1 1/20 0.35
TAS1R2 Q8TE23 1/20 0.35
SCN5A Q14524 1/20 0.35

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
SCHEMBL2295872 1.00 SCN9A (0.40) SCN9ANPC1RAB9ASMN1; SMN2TAS1R3
SCHEMBL2295312 0.87 TAS1R3 (0.47) SCN9ATAS1R3TAS1R1TAS1R2
SCHEMBL2287312 0.84 NPC1 (0.36) SCN9ANPC1RAB9ASMN1; SMN2TAS1R3
SCHEMBL4248890 0.84 TAS1R3 (0.46) TAS1R3TAS1R1TAS1R2
SCHEMBL2287310 0.84 NPC1 (0.36) SCN9ANPC1RAB9ASMN1; SMN2TAS1R3
SCHEMBL2285724 0.80 TAS1R3 (0.52) NPC1RAB9ASMN1; SMN2TAS1R3TAS1R1
SCHEMBL4248445 0.80 TAS1R3 (0.41) TAS1R3TAS1R1TAS1R2
SCHEMBL1928339 0.80 SCN9A (0.39) SCN9ASCN5A
SCHEMBL2292223 0.78 NPC1 (0.47) SCN9ANPC1RAB9ASCN5A
SCHEMBL2290146 0.75 DHODH (0.43) SCN9ASCN5A

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 SCN9A 1038/4885NPC1 435/4885RAB9A 236/4885

“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.