SCHEMBL7366994

SCHEMBL7366994

CC(C)(O)[C@H]1CC[C@H](CNC(=O)c2cccnc2Oc2ccc(F)c(F)c2)CC1

nearest known ligand 0.56

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
CARM1 Q86X55 1/20 0.46
PRMT6 Q96LA8 1/20 0.46
PDE4A P27815 1/20 0.46
PDE4B Q07343 1/20 0.46
PDE4C Q08493 1/20 0.46
PDE4D Q08499 1/20 0.46
GAA P10253 1/20 0.45

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
SCHEMBL7366991 1.00 CARM1 (0.46) CARM1PRMT6PDE4APDE4BPDE4C
SCHEMBL7368199 0.90 SLC22A12 (0.41) PDE4APDE4BPDE4CPDE4DGAA
SCHEMBL7369357 0.90 KMT2A (0.50) PDE4APDE4BPDE4CPDE4DGAA
SCHEMBL7371277 0.87 ALDH1A1 (0.48) GAA
SCHEMBL7406794 0.86 MAPK8 (0.51)
SCHEMBL7681556 0.85 CARM1 (0.48) CARM1PRMT6
SCHEMBL7681563 0.85 CARM1 (0.48) CARM1PRMT6
SCHEMBL7371639 0.85 PDE4A (0.55) PDE4APDE4BPDE4CPDE4DGAA
SCHEMBL4825943 0.85 AURKA (0.43) GAA
SCHEMBL7404893 0.85 MAPK8 (0.45) GAA

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