SCHEMBL7402170

SCHEMBL7402170

O=C(CCc1ccc(F)cc1)c1cccnc1Oc1cccnc1

nearest known ligand 0.53

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 1/20 0.48
ALDH1A1 P00352 1/20 0.45
MAPK8 P45983 1/20 0.42
EPHX2 P34913 1/20 0.41

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
SCHEMBL7368640 0.90 ALDH1A1 (0.54) ALDH1A1MAPK8
SCHEMBL7677512 0.89 KMT2A (0.53) KMT2AALDH1A1MAPK8
SCHEMBL7400057 0.85 KMT2A (0.49) KMT2AMAPK8
SCHEMBL7403292 0.85 ALDH1A1 (0.42) ALDH1A1MAPK8
SCHEMBL7369624 0.85 KMT2A (0.57) KMT2AALDH1A1MAPK8
SCHEMBL7372342 0.83 PDE10A (0.48) KMT2AALDH1A1
SCHEMBL7684313 0.82 KMT2A (0.47) KMT2AALDH1A1
SCHEMBL7368595 0.81 KMT2A (0.50) KMT2AALDH1A1MAPK8
SCHEMBL7370313 0.81 MAPK8 (0.67) KMT2AMAPK8
SCHEMBL5218853 0.76 ALDH1A1 (0.54) KMT2AALDH1A1MAPK8

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