SCHEMBL7367004

SCHEMBL7367004

N#Cc1cc(Oc2ncccc2C(=O)O)ccc1F

nearest known ligand 0.47

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
SLC22A12 Q96S37 1/20 0.47
HAO1 Q9UJM8 3/20 0.46
RAB9A P51151 1/20 0.45
GRM4 Q14833 1/20 0.44
TDP1 Q9NUW8 1/20 0.43
KMT2A Q03164 1/20 0.43
PDE10A Q9Y233 2/20 0.43
ALDH1A1 P00352 1/20 0.42
NAPRT Q6XQN6 1/20 0.42

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
SCHEMBL4733431 0.85 BACE1 (0.44) HAO1RAB9AGRM4NAPRT
SCHEMBL6460814 0.84 CARM1 (0.52) RAB9ATDP1KMT2APDE10AALDH1A1
SCHEMBL7366258 0.84 L3MBTL1 (0.52) SLC22A12RAB9ATDP1KMT2AALDH1A1
SCHEMBL2336921 0.81 RAB9A (0.54) RAB9ATDP1KMT2APDE10AALDH1A1
SCHEMBL851191 0.79 TDP1 (0.52) RAB9ATDP1KMT2APDE10AALDH1A1
SCHEMBL5362007 0.79 HCRTR1 (0.49) HAO1TDP1ALDH1A1
SCHEMBL2779361 0.77 KMT2A (0.65) RAB9ATDP1KMT2APDE10AALDH1A1
SCHEMBL4734047 0.77 BACE1 (0.43) SLC22A12HAO1RAB9AGRM4
SCHEMBL7313745 0.77 KMT2A (0.54) TDP1KMT2AALDH1A1NAPRT
SCHEMBL7363608 0.76 KMT2A (0.53) RAB9ATDP1KMT2APDE10AALDH1A1

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