SCHEMBL7369514

SCHEMBL7369514

CCOC(=O)c1cccnc1Oc1ccc(F)c(F)c1

nearest known ligand 0.52

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
CARM1 Q86X55 1/20 0.52
PRMT6 Q96LA8 1/20 0.52
L3MBTL1 Q9Y468 3/20 0.49
ALDH1A1 P00352 3/20 0.49
NPC1 O15118 2/20 0.49
POLB P06746 2/20 0.49
KMT2A Q03164 1/20 0.49
ATM Q13315 1/20 0.49
LMNA P02545 1/20 0.49
TDP1 Q9NUW8 1/20 0.49
MAPK1 P28482 1/20 0.48
RAB9A P51151 2/20 0.47
SMN1; SMN2 Q16637 1/20 0.47
P2RX3 P56373 1/20 0.47

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
SCHEMBL7366258 0.87 L3MBTL1 (0.52) L3MBTL1ALDH1A1NPC1POLBKMT2A
SCHEMBL3454518 0.86 POLB (0.61) L3MBTL1ALDH1A1NPC1POLBKMT2A
SCHEMBL27653419 0.86 TDP1 (0.67) CARM1PRMT6ALDH1A1KMT2ATDP1
SCHEMBL7370199 0.85 TDP1 (0.52) L3MBTL1ALDH1A1NPC1POLBKMT2A
SCHEMBL7372704 0.85 NPC1 (0.54) L3MBTL1ALDH1A1NPC1POLBKMT2A
SCHEMBL8560540 0.83 GAA (0.62) L3MBTL1ALDH1A1POLBKMT2ATDP1
SCHEMBL3454297 0.83 CYP1A2 (0.62) L3MBTL1ALDH1A1NPC1POLBKMT2A
SCHEMBL6460814 0.82 CARM1 (0.52) CARM1PRMT6ALDH1A1POLBKMT2A
SCHEMBL20831533 0.82 TDP1 (0.72) L3MBTL1ALDH1A1POLBLMNATDP1
SCHEMBL15912476 0.81 TDP1 (0.57) L3MBTL1ALDH1A1NPC1POLBTDP1

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