SCHEMBL9836855

SCHEMBL9836855

CCCCCNc1nc(CCl)cs1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 5/20 0.55
MAPT P10636 4/20 0.55
RAB9A P51151 4/20 0.55
ALDH1A1 P00352 2/20 0.55
STAT1 P42224 1/20 0.55
KMT2A Q03164 3/20 0.50
SMN1; SMN2 Q16637 2/20 0.50
PDE5A O76074 1/20 0.40
GAA P10253 2/20 0.39
KDM4E B2RXH2 2/20 0.39
MMP3 P08254 1/20 0.39
POLB P06746 1/20 0.39
NPY5R Q15761 4/20 0.37
TYR P14679 1/20 0.37
TSHR P16473 1/20 0.36
MAPK1 P28482 1/20 0.36
KCNH3 Q9ULD8 1/20 0.36
GPR84 Q9NQS5 1/20 0.35
GFER P55789 1/20 0.35
MEN1 O00255 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
SCHEMBL28154659 0.85 NPC1 (0.56) NPC1MAPTRAB9AALDH1A1STAT1
SCHEMBL10466181 0.83 NPC1 (0.54) NPC1MAPTRAB9AALDH1A1STAT1
SCHEMBL4099165 0.78 RAB9A (0.59) NPC1MAPTRAB9AALDH1A1STAT1
SCHEMBL11498389 0.78 PDE5A (0.50) NPC1MAPTRAB9AALDH1A1STAT1
SCHEMBL3507053 0.78 NPC1 (0.49) NPC1MAPTRAB9AALDH1A1STAT1
SCHEMBL24590345 0.77 RAB9A (0.57) NPC1MAPTRAB9AALDH1A1STAT1
SCHEMBL27686804 0.76 NPC1 (0.47) NPC1MAPTRAB9AALDH1A1STAT1
SCHEMBL4685246 0.75 PDE5A (0.70) NPC1MAPTRAB9AALDH1A1KMT2A
SCHEMBL1860420 0.73
SCHEMBL13105682 0.73 NPC1 (0.43) NPC1MAPTRAB9AALDH1A1STAT1

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
EP-0224919-B1 NEW THIAZOLE COMPOUNDS, PROCESSES FOR THE PREPARATION THEREOF AND PHARMACEUTICAL COMPOSITION COMPRISING THE SAME FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1991-08-14 EP disclosed
US-4742057-A Antiallergic thiazole compounds FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1988-05-03 US disclosed
EP-0224919-A2 New thiazole compounds, processes for the preparation thereof and pharmaceutical composition comprising the same FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1987-06-10 EP disclosed