SCHEMBL7792597

SCHEMBL7792597

COc1cc(O)c(Cl)cc1Cl

nearest known ligand 0.56

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 1/20 0.56
HPGD P15428 1/20 0.52
TSHR P16473 1/20 0.52
HSD17B10 Q99714 1/20 0.52
GAA P10253 1/20 0.50
FTO Q9C0B1 1/20 0.45
DPP4 P27487 8/20 0.44
TAAR1 Q96RJ0 1/20 0.42
HTT P42858 1/20 0.42
RET P07949 1/20 0.42
KIF5B P33176 1/20 0.42
KDR P35968 1/20 0.42
MAOA P21397 1/20 0.41
MAOB P27338 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
SCHEMBL11548272 0.91 TSHR (0.52) NPC1HPGDTSHRHSD17B10GAA
SCHEMBL11003488 0.88 HTT (0.48) HPGDTSHRHSD17B10DPP4HTT
SCHEMBL69147 0.86 HSD17B10 (0.52) HPGDTSHRHSD17B10FTODPP4
SCHEMBL19914317 0.82 GAA (0.47) NPC1HPGDHSD17B10GAADPP4
SCHEMBL16609990 0.82 GAA (0.68) NPC1HPGDGAATAAR1
SCHEMBL4398163 0.81 GAA (0.56) NPC1HPGDHSD17B10GAAFTO
SCHEMBL25664040 0.81 MAOB (0.46) NPC1HPGDTSHRHSD17B10GAA
SCHEMBL6816624 0.80 GAA (0.67) NPC1HPGDTSHRHSD17B10GAA
SCHEMBL21614378 0.80 DPP4 (0.46) HPGDTSHRHSD17B10DPP4
SCHEMBL21611906 0.80 HMGCR (0.41) NPC1HPGDTSHRHSD17B10DPP4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9663508-B2 Biaryl acyl-sulfonamide compounds as sodium channel inhibitors AMGEN INC. (US) 2017-05-30 US disclosed
US-9663508-B2 Biaryl acyl-sulfonamide compounds as sodium channel inhibitors AMGEN INC. (US) 2017-05-30 US disclosed
US-20160214971-A1 Biaryl Acyl-Sulfonamide Compounds as Sodium Channel Inhibitors One Amgen Center Drive (US) 2016-07-28 US disclosed
US-20160214971-A1 Biaryl Acyl-Sulfonamide Compounds as Sodium Channel Inhibitors One Amgen Center Drive (US) 2016-07-28 US disclosed
EP-0850246-B1 PYRIMIDINE NUCLEOSIDE DERIVATIVES HOFFMANN LA ROCHE (CH) 2001-11-14 EP disclosed
EP-0850247-A1 PYRIMIDINE NUCLEOSIDE DERIVATIVE F. HOFFMANN-LA ROCHE AG (CH) 1998-07-01 EP disclosed
EP-0850246-A2 PYRIMIDINE NUCLEOSIDE DERIVATIVES F. HOFFMANN-LA ROCHE AG (CH) 1998-07-01 EP disclosed
US-5705492-A ESTERIFICATION OF PYRIMIDINE NUCLEOSIDE HOFFMANN-LA ROCHE INC. (US) 1998-01-06 US disclosed
US-5698532-A VIRICIDE THAT FUNCTIONS AS A THYMIDINE KINASE ENZYME INHIBITOR FOR TREATMENT OR PROPHYLAXIS OF HERPES SIMPLEX VIRUS; ENHANCED BIOAVAILABILITY HOFFMANN-LA ROCHE INC. (US) 1997-12-16 US disclosed
WO-1997003082-A2 PYRIMIDINE NUCLEOSIDE DERIVATIVES F. HOFFMANN-LA ROCHE AG (CH) 1997-01-30 WO disclosed
WO-1997003083-A1 PYRIMIDINE NUCLEOSIDE DERIVATIVE F. HOFFMANN-LA ROCHE AG (CH) 1997-01-30 WO disclosed
US-4216342-A Process for the purification of crude 2,4,5-trichlorophenol GIVAUDAN CORPORATION (US) 1980-08-05 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-20160214971-A1 Biaryl Acyl-Sulfonamide Compounds as Sodium Channel Inhibitors SCN1A, SCN1B, SCN5A NPC1 698/4885HPGD 2282/4885TSHR 4239/4885

“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.