SCHEMBL13201441

SCHEMBL13201441

CCc1nc(COO)cs1

nearest known ligand 0.41

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
SLC6A3 Q01959 1/20 0.41
KMT2A Q03164 3/20 0.33
PDE8B O95263 1/20 0.33
PDE10A Q9Y233 1/20 0.33
NPC1 O15118 3/20 0.33
RAB9A P51151 3/20 0.33
SMN1; SMN2 Q16637 3/20 0.33
L3MBTL1 Q9Y468 1/20 0.32
BCHE P06276 3/20 0.32
F2RL3 Q96RI0 1/20 0.32
PKM P14618 1/20 0.31
MEN1 O00255 2/20 0.31
ALDH1A1 P00352 1/20 0.31

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
SCHEMBL10744688 0.82 SLC6A3 (0.42) SLC6A3KMT2APDE8BPDE10ANPC1
SCHEMBL2256127 0.79
SCHEMBL8219198 0.78
Hydrochloric Acid SCHEMBL10988638 0.77 SLC6A3 (0.46) SLC6A3PDE8BPDE10ANPC1RAB9A
Ammonia Solution, Strong SCHEMBL27615021 0.77 SLC6A3 (0.46) SLC6A3PDE8BPDE10ANPC1RAB9A
SCHEMBL5539297 0.77 SLC6A3 (0.41) SLC6A3KMT2APDE8BPDE10ANPC1
SCHEMBL17635760 0.76
SCHEMBL8219163 0.75 SLC6A3 (0.40) SLC6A3KMT2APDE8BPDE10AL3MBTL1
SCHEMBL12951903 0.74 SLC6A3 (0.44) SLC6A3PDE8BNPC1RAB9A
SCHEMBL15356506 0.74

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7772285-B2 Benzophenone derivatives or salts thereof TOYAMA CHEMICAL CO., LTD. (JP) 2010-08-10 US disclosed