SCHEMBL8516006

SCHEMBL8516006

FC(F)(F)Oc1ccc2nc(N3CCNCC3)sc2c1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SCN4A P35499 3/20 1.00
SCN9A Q15858 3/20 1.00
NPC1 O15118 10/20 0.54
RAB9A P51151 10/20 0.54
SMN1; SMN2 Q16637 6/20 0.54
TP53 P04637 3/20 0.54
CYP1A2 P05177 2/20 0.54
CYP3A4 P08684 2/20 0.54
CYP2C9 P11712 2/20 0.54
NFKB1 P19838 2/20 0.54
LMNA P02545 2/20 0.54
GAA P10253 2/20 0.54
GMNN O75496 1/20 0.54
USP2 O75604 1/20 0.54
ADORA3 P0DMS8 1/20 0.54
PKM P14618 1/20 0.54
ALOX15 P16050 1/20 0.54
SLC6A2 P23975 1/20 0.54
BLM P54132 1/20 0.54
PMP22 Q01453 1/20 0.54

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
SCHEMBL16445277 0.88 SCN4A (0.79) SCN4ASCN9ANPC1RAB9ASMN1; SMN2
SCHEMBL2708042 0.83 SCN4A (0.71) SCN4ASCN9ANPC1RAB9ASMN1; SMN2
SCHEMBL13629452 0.81 SCN4A (0.67) SCN4ASCN9ANPC1RAB9ASMN1; SMN2
SCHEMBL2710713 0.81 SCN4A (0.67) SCN4ASCN9ANPC1RAB9ASMN1; SMN2
SCHEMBL4061174 0.80 MAPT (0.77) SCN4ASCN9ANPC1RAB9ASMN1; SMN2
SCHEMBL2709101 0.80 SCN4A (0.67) SCN4ASCN9ANPC1RAB9ASMN1; SMN2
SCHEMBL12469024 0.79 SCN4A (0.65) SCN4ASCN9ANPC1RAB9ASMN1; SMN2
SCHEMBL2710695 0.79 NPC1 (0.76) SCN4ASCN9ANPC1RAB9ASMN1; SMN2
SCHEMBL10219273 0.77 SCN4A (0.62) SCN4ASCN9ANPC1RAB9ASMN1; SMN2
SCHEMBL3232592 0.76 SCN4A (0.61) SCN4ASCN9ANPC1RAB9ASMN1; SMN2

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 22 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9156834-B2 Derivatives of heteroarylsulfonamides, their preparation and their application in human therapy PIERRE FABRE MEDICAMENT (FR) 2015-10-13 US disclosed
US-9156834-B2 Derivatives of heteroarylsulfonamides, their preparation and their application in human therapy PIERRE FABRE MEDICAMENT (FR) 2015-10-13 US disclosed
US-9156834-B2 Derivatives of heteroarylsulfonamides, their preparation and their application in human therapy PIERRE FABRE MEDICAMENT (FR) 2015-10-13 US disclosed
US-20140357624-A1 DERIVATIVES OF HETEROARYLSULFONAMIDES, THEIR PREPARATION AND THEIR APPLICATION IN HUMAN THERAPY PF MEDICAMENT (FR) 2014-12-04 US disclosed
US-20140357624-A1 DERIVATIVES OF HETEROARYLSULFONAMIDES, THEIR PREPARATION AND THEIR APPLICATION IN HUMAN THERAPY PF MEDICAMENT (FR) 2014-12-04 US disclosed
US-20140357624-A1 DERIVATIVES OF HETEROARYLSULFONAMIDES, THEIR PREPARATION AND THEIR APPLICATION IN HUMAN THERAPY PF MEDICAMENT (FR) 2014-12-04 US disclosed
US-8846930-B2 Derivatives of heteroarylsulfonamides, their preparation and their application in human therapy PIERRE FABRE MEDICAMENT (FR) 2014-09-30 US disclosed
US-8846930-B2 Derivatives of heteroarylsulfonamides, their preparation and their application in human therapy PIERRE FABRE MEDICAMENT (FR) 2014-09-30 US disclosed
US-8846930-B2 Derivatives of heteroarylsulfonamides, their preparation and their application in human therapy PIERRE FABRE MEDICAMENT (FR) 2014-09-30 US disclosed
US-8759382-B2 Propargyl-trifluoromethoxy-aminobenzothiazole derivatives, their preparation and use TEVA PHARMACEUTICAL INDUSTRIES LTD. (IL) 2014-06-24 US disclosed
EP-2621490-A2 PROPARGYL-TRIFLUOROMETHOXY-AMINOBENZOTHIAZOLE DERIVATIVES, THEIR PREPARATION AND USE Teva Pharmaceutical Industries Ltd. (IL) 2013-08-07 EP disclosed
CN-103209980-A Derivatives of heteroarylsulfonamides, their preparation and their application in human therapy PF MEDICAMENT 2013-07-17 CN disclosed
US-20130172364-A1 PROPARGYL-TRIFLUOROMETHOXY-AMINOBENZOTHIAZOLE DERIVATIVES, THEIR PREPARATION AND USE TEVA PHARMACEUTICAL INDUSTRIES LTD. (IL) 2013-07-04 US disclosed
US-20130172364-A1 PROPARGYL-TRIFLUOROMETHOXY-AMINOBENZOTHIAZOLE DERIVATIVES, THEIR PREPARATION AND USE TEVA PHARMACEUTICAL INDUSTRIES LTD. (IL) 2013-07-04 US disclosed
US-20130172326-A1 DERIVATIVES OF HETEROARYLSULFONAMIDES, THEIR PREPARATION AND THEIR APPLICATION IN HUMAN THERAPY PIERRE FABRE MEDICAMENT (FR) 2013-07-04 US disclosed
US-20130172326-A1 DERIVATIVES OF HETEROARYLSULFONAMIDES, THEIR PREPARATION AND THEIR APPLICATION IN HUMAN THERAPY PIERRE FABRE MEDICAMENT (FR) 2013-07-04 US disclosed
US-20130172326-A1 DERIVATIVES OF HETEROARYLSULFONAMIDES, THEIR PREPARATION AND THEIR APPLICATION IN HUMAN THERAPY PIERRE FABRE MEDICAMENT (FR) 2013-07-04 US disclosed
WO-2012069503-A1 DERIVATIVES OF HETEROARYLSULFONAMIDES, THEIR PREPARATION AND THEIR APPLICATION IN HUMAN THERAPY PIERRE FABRE MEDICAMENT (FR) 2012-05-31 WO disclosed
WO-2012069503-A1 DERIVATIVES OF HETEROARYLSULFONAMIDES, THEIR PREPARATION AND THEIR APPLICATION IN HUMAN THERAPY PIERRE FABRE MEDICAMENT (FR) 2012-05-31 WO disclosed
WO-2012050971-A2 PROPARGYL-TRIFLUOROMETHOXY-AMINOBENZOTHIAZOLE DERIVATIVES, THEIR PREPARATION AND USE TEVA PHARMACEUTICAL INDUSTRIES LTD. (IL) 2012-04-19 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 (3 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-20130172326-A1 DERIVATIVES OF HETEROARYLSULFONAMIDES, THEIR PREPARATION AND THEIR APPLICATION IN HUMAN THERAPY KCNA4, KCNA1, KCNB1 SCN4A 42/4885SCN9A 78/4885NPC1 832/4885
US-20140357624-A1 DERIVATIVES OF HETEROARYLSULFONAMIDES, THEIR PREPARATION AND THEIR APPLICATION IN HUMAN THERAPY KCNA4, KCNA1, KCNB1 SCN4A 42/4885SCN9A 78/4885NPC1 832/4885
US-20130172364-A1 PROPARGYL-TRIFLUOROMETHOXY-AMINOBENZOTHIAZOLE DERIVATIVES, THEIR PREPARATION AND USE PARK7, SNCA, PMP22 SCN4A 1420/4885SCN9A 2465/4885NPC1 2744/4885

“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.