SCHEMBL1018351

SCHEMBL1018351

COc1ccc(Cc2nsc(NCCCCCN)n2)cc1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.40
NPC1 O15118 2/20 0.40
MAPT P10636 1/20 0.40
RAB9A P51151 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
HSP90AA1 P07900 1/20 0.39
HSP90AB1 P08238 1/20 0.39
CHRM2 P08172 1/20 0.39
TLR8 Q9NR97 1/20 0.38
TLR7 Q9NYK1 1/20 0.38
ALDH1A1 P00352 4/20 0.37
CYP2D6 P10635 1/20 0.37
ATM Q13315 1/20 0.37
TAAR1 Q96RJ0 1/20 0.37
HTR6 P50406 1/20 0.37
LTA4H P09960 1/20 0.36
HPGD P15428 2/20 0.36
MEN1 O00255 1/20 0.36
TP53 P04637 1/20 0.36
HTT P42858 1/20 0.36

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
SCHEMBL1020823 1.00 LMNA (0.40) LMNANPC1MAPTRAB9ASMN1; SMN2
SCHEMBL1022872 0.99 MAPT (0.41) LMNANPC1MAPTRAB9ASMN1; SMN2
SCHEMBL1023567 0.95 MAPT (0.42) LMNANPC1MAPTRAB9ASMN1; SMN2
SCHEMBL1019458 0.90 MAPT (0.43) LMNANPC1MAPTRAB9ASMN1; SMN2
SCHEMBL1020799 0.87 CHRM2 (0.44) NPC1HSP90AA1HSP90AB1CHRM2TLR8
SCHEMBL1020605 0.87 CHRM2 (0.44) NPC1HSP90AA1HSP90AB1CHRM2TLR8
SCHEMBL1020759 0.86 SYK (0.37) LMNANPC1RAB9ASMN1; SMN2CHRM2
SCHEMBL1022485 0.86 SYK (0.37) LMNANPC1RAB9ASMN1; SMN2CHRM2
SCHEMBL1020669 0.86 MAPT (0.44) LMNANPC1MAPTRAB9ASMN1; SMN2
SCHEMBL1019075 0.86 TAAR1 (0.44) NPC1HSP90AA1HSP90AB1CHRM2TLR8

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7960556-B2 Thiadiazole derivatives for the treatment of neuro-degenerative diseases NV REMYND (BE) 2011-06-14 US disclosed
EP-2094677-B1 THIADIAZOLE DERIVATIVES FOR THE TREATMENT OF NEURO-DEGENERATIVE DISEASES REMYND NV (BE) 2011-01-12 EP disclosed
US-20100144709-A1 THIADIAZOLE DERIVATIVES FOR THE TREATMENT OF NEURO-DEGENERATIVE DISEASES NV REMYND (BE) 2010-06-10 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-20100144709-A1 THIADIAZOLE DERIVATIVES FOR THE TREATMENT OF NEURO-DEGENERATIVE DISEASES SNCA, PARK7, PRNP LMNA 1913/4885NPC1 777/4885MAPT 4/4885

“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.