SCHEMBL679799

SCHEMBL679799

Cc1cc(Oc2ccc(C(=O)NS(C)(=O)=O)cc2)ccc1F

nearest known ligand 0.48

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
SCN9A Q15858 14/20 0.48
SCN5A Q14524 3/20 0.45
SCN2B O60939 2/20 0.45
SCN1B Q07699 2/20 0.45
PTPN1 P18031 1/20 0.44
CHEK2 O96017 1/20 0.44
HPGD P15428 1/20 0.44
TSHR P16473 1/20 0.44
HTT P42858 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
BCL2L1 Q07817 1/20 0.43
MCL1 Q07820 1/20 0.43
MMP13 P45452 1/20 0.43
SCN1A P35498 1/20 0.43
P4HTM Q9NXG6 1/20 0.42

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
SCHEMBL680206 0.89 SOS1 (0.50) SCN9APTPN1HPGDTSHRHTT
SCHEMBL679703 0.87 SCN9A (0.49) SCN9ASCN5ASCN2BSCN1BPTPN1
SCHEMBL679043 0.87 SCN9A (0.51) SCN9ASCN5ASCN2BSCN1BSCN1A
SCHEMBL680674 0.85 SCN9A (0.57) SCN9ASCN5ABCL2L1MCL1
SCHEMBL680494 0.84 SCN9A (0.57) SCN9ASCN5AHPGDTSHRHTT
SCHEMBL680594 0.83 SCN9A (0.52) SCN9ASCN5APTPN1
SCHEMBL703171 0.83 BCL2L1 (0.59) SCN9ASCN5ASCN2BSCN1BPTPN1
SCHEMBL679943 0.83 SCN9A (0.57) SCN9ASCN5A
SCHEMBL679760 0.82 BCL2L1 (0.49) SCN9ASCN5ASCN2BSCN1BPTPN1
SCHEMBL680642 0.82 SCN9A (0.50) SCN9ASCN5APTPN1MMP13

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2593427-B1 SULFONAMIDE DERIVATIVES AS NAV1.7 INHIBITORS FOR THE TREATMENT OF PAIN PFIZER LTD (GB) 2014-12-24 EP disclosed
US-20120010207-A1 Chemical Compounds PFIZER LIMITED (GB) 2012-01-12 US 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-20120010207-A1 Chemical Compounds SCN1A, SCN1B, SCN7A SCN9A 13/4885SCN5A 5/4885SCN2B 6/4885

“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.