SCHEMBL7369919

SCHEMBL7369919

O=C(O)c1cccnc1Oc1ccc2ncsc2c1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDE10A Q9Y233 2/20 0.50
RAB9A P51151 3/20 0.49
TDP1 Q9NUW8 2/20 0.49
NPC1 O15118 2/20 0.49
KDM4E B2RXH2 2/20 0.49
HKDC1 Q2TB90 1/20 0.49
L3MBTL1 Q9Y468 1/20 0.49
ALDH1A1 P00352 1/20 0.43
GPBAR1 Q8TDU6 1/20 0.41
GFER P55789 1/20 0.41
NAMPT P43490 1/20 0.40
MEN1 O00255 1/20 0.40
KMT2A Q03164 1/20 0.40
GAA P10253 1/20 0.40
MAPK8 P45983 1/20 0.40
ROCK2 O75116 1/20 0.40
LMNA P02545 1/20 0.39
POLB P06746 1/20 0.39
MAPT P10636 1/20 0.39
HPGD P15428 1/20 0.39

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
SCHEMBL7373185 0.84 TDP1 (0.44) RAB9ATDP1NPC1KDM4EL3MBTL1
SCHEMBL7374567 0.81 TDP1 (0.59) PDE10ARAB9ATDP1NPC1KDM4E
SCHEMBL4825784 0.80 PDE10A (0.49) PDE10ARAB9ATDP1KDM4EALDH1A1
SCHEMBL4825887 0.77 PDE10A (0.47) PDE10ARAB9ATDP1KDM4EALDH1A1
SCHEMBL7372896 0.76 PDE10A (0.56) PDE10ARAB9ATDP1NPC1L3MBTL1
SCHEMBL7374961 0.75 MAPK8 (0.52) MAPK8ROCK2LMNAHPGD
SCHEMBL7373289 0.75 PDE10A (0.46) PDE10ARAB9ATDP1NPC1KDM4E
SCHEMBL6460814 0.75 CARM1 (0.52) PDE10ARAB9ATDP1KDM4EALDH1A1
SCHEMBL7320114 0.75 RAB9A (0.55) PDE10ARAB9ATDP1ALDH1A1GAA
SCHEMBL2781858 0.75 TDP1 (0.52) PDE10ARAB9ATDP1NPC1KDM4E

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
US-6380218-B1 FOR THERAPY OF RESPIRATORY, ALLERGIC, AND INFLAMMATORY DISORDERS COMPRISING ASTHMA, CHRONIC OBSTRUCTIVE PULMONARY DISEASE, ACUTE RESPIRATORY DISEASE SYNDROME, PULMONARY HYPERSENSITIVITY, AND ALLERGIC RHINITIS IN A MAMMAL PFIZER INC 2002-04-30 US disclosed
EP-0971894-A1 NICOTINAMIDE DERIVATIVES Pfizer Products Inc. (US) 2000-01-19 EP disclosed
WO-1998045268-A1 NICOTINAMIDE DERIVATIVES PFIZER PRODUCTS INC. (US) 1998-10-15 WO disclosed