SCHEMBL366513

SCHEMBL366513

CCc1ccc(OCc2ccc(C(=O)NS(C)(=O)=O)c(OC)c2)cc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTGER4 P35408 1/20 0.47
ADRB1 P08588 2/20 0.45
ADRB3 P13945 2/20 0.45
RXRA P19793 1/20 0.44
RXRB P28702 1/20 0.44
NPC1 O15118 3/20 0.43
RAB9A P51151 3/20 0.43
HSP90AA1 P07900 1/20 0.43
HDAC3 O15379 1/20 0.43
HDAC1 Q13547 1/20 0.43
HDAC2 Q92769 1/20 0.43
PARP15 Q460N3 1/20 0.42
SCN9A Q15858 3/20 0.42
SCN5A Q14524 1/20 0.42
ALDH1A1 P00352 2/20 0.41
PTPN1 P18031 2/20 0.41
MAPT P10636 2/20 0.41
CYP4F2 P78329 1/20 0.41
CYP4A11 Q02928 1/20 0.41
HTT P42858 1/20 0.41

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
Diethylamine SCHEMBL16239544 0.96 ADRB1 (0.44) PTGER4ADRB1ADRB3RXRARXRB
SCHEMBL363861 0.86 RXRA (0.49) PTGER4RXRARXRBNPC1RAB9A
SCHEMBL16239837 0.85 SCN9A (0.60) SCN9ASCN5A
SCHEMBL364253 0.85 SCN9A (0.53) RXRARXRBSCN9ASCN5A
SCHEMBL10201822 0.83 SCN9A (0.60) PARP15SCN9ASCN5A
Diethylamine SCHEMBL16240278 0.82 RXRA (0.45) PTGER4RXRARXRBNPC1RAB9A
Diethylamine SCHEMBL16239835 0.81 SCN9A (0.49) RXRARXRBSCN9ASCN5A
SCHEMBL366237 0.80 HDAC8 (0.51) PTGER4RXRARXRBSCN9ASCN5A
SCHEMBL366649 0.79 ADRB3 (0.50) ADRB1ADRB3NPC1SCN9AALDH1A1
SCHEMBL364340 0.79 RXRA (0.62) RXRARXRBNPC1RAB9AHDAC3

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
US-9096500-B2 Acyl sulfonamide compounds PFIZER LIMITED (GB) 2015-08-04 US disclosed
EP-2593428-A2 N-SULFONYLBENZAMIDES AS INHIBITORS OF VOLTAGE-GATED SODIUM CHANNELS Pfizer Limited (GB) 2013-05-22 EP disclosed
US-20130109701-A1 Chemical Compounds PFIZER LIMITED (GB) 2013-05-02 US disclosed
WO-2012007868-A2 CHEMICAL COMPOUNDS PFIZER LIMITED (GB) 2012-01-19 WO 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-20130109701-A1 Chemical Compounds SCN1A, SCN1B, SCN7A PTGER4 1876/4885ADRB1 293/4885ADRB3 726/4885

“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.