SCHEMBL10429482

SCHEMBL10429482

Cc1ccccc1Nc1nc(O)cc(O)n1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPSR1 Q6W5P4 2/20 0.53
CYP3A4 P08684 1/20 0.53
CYP2C9 P11712 1/20 0.53
NTSR1 P30989 1/20 0.53
CYP2C19 P33261 1/20 0.53
KMT2A Q03164 1/20 0.53
HTT P42858 3/20 0.50
LMNA P02545 3/20 0.50
NPC1 O15118 2/20 0.50
RAB9A P51151 2/20 0.50
SMN1; SMN2 Q16637 2/20 0.50
PKM P14618 1/20 0.50
NFKB1 P19838 1/20 0.50
NFKB2 Q00653 1/20 0.50
RELA Q04206 1/20 0.50
MAPK10 P53779 1/20 0.49
LRRK2 Q5S007 2/20 0.48
MAPT P10636 3/20 0.48
SLC2A1 P11166 1/20 0.48
GAA P10253 1/20 0.48

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
SCHEMBL13750837 0.84 HTT (0.59) NPSR1CYP3A4CYP2C9NTSR1CYP2C19
SCHEMBL9506004 0.80 RAB9A (0.52) NPSR1KMT2AHTTLMNANPC1
SCHEMBL10429444 0.78 TSHR (0.65) NPSR1KMT2ANPC1RAB9ASMN1; SMN2
SCHEMBL10429487 0.77 MAPT (0.64) NPSR1KMT2AHTTNPC1RAB9A
SCHEMBL23795778 0.76 NPC1 (0.71) NPSR1HTTLMNANPC1RAB9A
SCHEMBL4544839 0.76 SLC2A1 (0.65) NPSR1CYP3A4CYP2C9NTSR1CYP2C19
SCHEMBL4544852 0.76 SLC2A1 (0.65) NPSR1CYP3A4CYP2C9NTSR1CYP2C19
SCHEMBL9483332 0.76 NPSR1 (0.54) NPSR1CYP3A4CYP2C9NTSR1CYP2C19
SCHEMBL8633131 0.76 HTT (0.51) NPSR1CYP3A4CYP2C9NTSR1CYP2C19
SCHEMBL10939229 0.76 TSHR (0.67) NPSR1CYP3A4CYP2C9NTSR1CYP2C19

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-4942225-A Preparation of diazo and azo compounds using azidoformamidium salts BAYER AKTIENGESELLSCHAFT (DE) 1990-07-17 US disclosed