SCHEMBL142550

SCHEMBL142550

Cc1c2n(c3ccccc13)-c1ccccc1C2=S

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.39
IDO1 P14902 2/20 0.39
LMNA P02545 2/20 0.39
RAB9A P51151 2/20 0.39
TDO2 P48775 2/20 0.39
IDO2 Q6ZQW0 2/20 0.39
NPC1 O15118 1/20 0.39
NTRK1 P04629 1/20 0.39
ALOX5 P09917 1/20 0.39
PTGS2 P35354 1/20 0.39
HTT P42858 1/20 0.39
MAPK8 P45983 1/20 0.39
KMT2A Q03164 1/20 0.39
NTRK2 Q16620 1/20 0.39
HDAC6 Q9UBN7 1/20 0.39
TSHR P16473 1/20 0.36
NPSR1 Q6W5P4 1/20 0.35
KDM4E B2RXH2 5/20 0.35
RECQL P46063 1/20 0.35
CYP11B2 P19099 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
SCHEMBL29930277 0.80 NTRK1 (0.49) MAPTIDO1LMNARAB9ATDO2
SCHEMBL154140 0.80 NTRK1 (0.49) MAPTIDO1LMNARAB9ATDO2
SCHEMBL22327516 0.70 ALDH1A1 (0.43) MAPTIDO1LMNARAB9ATDO2
SCHEMBL4884634 0.70 TSHR (0.46) MAPTLMNARAB9AHTTKMT2A
SCHEMBL622966 0.69 ALDH1A1 (0.53) MAPTIDO1LMNARAB9ATDO2
SCHEMBL30198171 0.69 ALDH1A1 (0.53) MAPTIDO1LMNARAB9ATDO2
SCHEMBL31549508 0.69 ALDH1A1 (0.46) MAPTLMNANTRK1HTTKDM4E
SCHEMBL19766159 0.69 ALDH1A1 (0.46) MAPTLMNANTRK1HTTKDM4E
SCHEMBL28393409 0.69 RAB9A (0.49) MAPTLMNARAB9ANTRK1HTT
SCHEMBL12856738 0.69 ALDH1A1 (0.39) MAPTIDO1LMNARAB9ATDO2

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-8940909-B2 Indicator platform BIOSYNTH AG (CH) 2015-01-27 US disclosed
US-8940909-B2 Indicator platform BIOSYNTH AG (CH) 2015-01-27 US disclosed
US-20120058503-A1 Novel Indicator Platform BIOSYNTH AG (CH) 2012-03-08 US disclosed
US-20120058503-A1 Novel Indicator Platform BIOSYNTH AG (CH) 2012-03-08 US disclosed
EP-2256103-A1 Novel indicator platform Biosynth AG (CH) 2010-12-01 EP disclosed
EP-2256103-A1 Novel indicator platform Biosynth AG (CH) 2010-12-01 EP disclosed