SCHEMBL14488175

SCHEMBL14488175

Cc1ccc(-c2nsc(Cl)n2)cn1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ADORA3 P0DMS8 1/20 0.42
NPC1 O15118 2/20 0.40
RAB9A P51151 2/20 0.40
PKM P14618 1/20 0.40
PIK3CD O00329 1/20 0.38
PIK3CA P42336 1/20 0.38
PIK3CB P42338 1/20 0.38
PI4KA P42356 1/20 0.38
PIK3CG P48736 1/20 0.38
PI4KB Q9UBF8 1/20 0.38
HPGDS O60760 1/20 0.38
CYP19A1 P11511 2/20 0.37
PTGS2 P35354 6/20 0.36
PTGS1 P23219 2/20 0.36
GBA1 P04062 1/20 0.36
MEN1 O00255 1/20 0.36
LMNA P02545 1/20 0.36
KMT2A Q03164 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
ELANE P08246 1/20 0.35

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
SCHEMBL13662710 0.79 ADORA3 (0.53) ADORA3NPC1RAB9APKMPIK3CD
SCHEMBL3764405 0.78 NR1H4 (0.47) ADORA3NPC1RAB9ACYP19A1MEN1
SCHEMBL14488216 0.76 CASP3 (0.52) PIK3CDPIK3CAPIK3CBPI4KAPIK3CG
SCHEMBL3765867 0.74 CYP19A1 (0.67) NPC1RAB9ACYP19A1LMNASMN1; SMN2
SCHEMBL1219538 0.74 NPC1 (0.53) ADORA3NPC1RAB9ACYP19A1MEN1
SCHEMBL14755613 0.71 CYP19A1 (0.39) ADORA3NPC1RAB9ACYP19A1MEN1
SCHEMBL3979477 0.71 LMNA (0.43) ADORA3NPC1RAB9ACYP19A1MEN1
SCHEMBL3771469 0.71 LMNA (0.43) ADORA3NPC1RAB9ACYP19A1MEN1
SCHEMBL14755751 0.70 RAB9A (0.49) NPC1RAB9ACYP19A1MEN1LMNA
SCHEMBL930343 0.70 ADORA3 (0.59) ADORA3NPC1RAB9AMEN1LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9023852-B2 1, 2, 4-thiadiazol-5-ylpiperazine derivatives useful in the treatment of neurodegenerative diseases REMYND NV (BE) 2015-05-05 US disclosed
EP-2726470-B1 1,2,4-THIADIAZOL-5-YLPIPERAZINE DERIVATIVES USEFUL IN THE TREATMENT OF NEURODEGENERATIVE DISEASES REMYND NV (BE) 2015-04-29 EP disclosed
US-20140128404-A1 1, 2, 4-Thiadiazol-5-Ylpiperazine derivatives useful in the treatment of neurodegenerative diseases REMYND NV (BE) 2014-05-08 US disclosed
EP-2726470-A1 1, 2, 4 -THIADIAZOL- 5 -YLPIPERAZINE DERIVATIVES USEFUL IN THE TREATMENT NEURODEGENERATIVE DISEASES reMynd NV (BE) 2014-05-07 EP disclosed
CN-103619825-A 1, 2, 4-thiadiazol-5-ylpiperazine derivatives useful in the treatment neurodegenerative diseases REMYND NV 2014-03-05 CN disclosed
WO-2013004642-A1 1, 2, 4 -THIADIAZOL- 5 -YLPIPERAZINE DERIVATIVES USEFUL IN THE TREATMENT NEURODEGENERATIVE DISEASES REMYND NV (BE) 2013-01-10 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-20140128404-A1 1, 2, 4-Thiadiazol-5-Ylpiperazine derivatives useful in the treatment of neurodegenerative diseases MAPT, PSEN1, PSEN2 ADORA3 4313/4885NPC1 389/4885RAB9A 2796/4885

“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.