SCHEMBL7407683

SCHEMBL7407683

CC(C)(O)c1ccc(CNC(=O)c2cccnc2Oc2ccc3c(c2)C(=O)CCO3)cc1

nearest known ligand 0.50

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
MAPK8 P45983 2/20 0.48
HPGD P15428 2/20 0.45
LMNA P02545 1/20 0.45
SMN1; SMN2 Q16637 1/20 0.45
PDE4A P27815 1/20 0.45
PDE4B Q07343 1/20 0.45
PDE4C Q08493 1/20 0.45
PDE4D Q08499 1/20 0.45
KDM4E B2RXH2 1/20 0.43
TSHR P16473 1/20 0.43
NPSR1 Q6W5P4 1/20 0.43
POLB P06746 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
SCHEMBL7367596 0.88 PDE4A (0.54) MAPK8HPGDLMNASMN1; SMN2PDE4A
SCHEMBL7369368 0.88 MAPK8 (0.52) MAPK8HPGDLMNASMN1; SMN2
SCHEMBL5362716 0.85 PDE4A (0.60) MAPK8HPGDLMNASMN1; SMN2PDE4A
SCHEMBL7370502 0.80 MAPK8 (0.62) MAPK8HPGDLMNASMN1; SMN2KDM4E
SCHEMBL7365815 0.79 MAPK8 (0.56) MAPK8HPGDLMNASMN1; SMN2PDE4A
SCHEMBL4825983 0.79 MAPK8 (0.53) MAPK8HPGDLMNASMN1; SMN2
SCHEMBL7373017 0.78 MAPK8 (0.60) MAPK8HPGDLMNASMN1; SMN2POLB
SCHEMBL7366732 0.78 HPGD (0.61) MAPK8HPGDLMNASMN1; SMN2POLB
SCHEMBL7367449 0.78 MAPK8 (0.48) MAPK8HPGDLMNASMN1; SMN2
SCHEMBL3086802 0.78 MAPK8 (0.62) MAPK8HPGDLMNASMN1; SMN2

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