SCHEMBL7368852

SCHEMBL7368852

CC(=O)c1ccc(CNC(=O)c2cccnc2Oc2ccc(F)cc2)cc1

nearest known ligand 0.85

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
MAPK8 P45983 1/20 0.65
PTGER4 P35408 3/20 0.60
PTGER2 P43116 1/20 0.57
LMNA P02545 1/20 0.57
HPGD P15428 1/20 0.57
SMN1; SMN2 Q16637 1/20 0.57
CYP3A4 P08684 1/20 0.57
MAPK14 Q16539 1/20 0.57

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
SCHEMBL7317640 0.92 MAPK8 (0.75) MAPK8PTGER4PTGER2LMNAHPGD
SCHEMBL7371446 0.89 LMNA (0.72) MAPK8LMNAHPGDSMN1; SMN2
SCHEMBL4086210 0.88 MAPK8 (0.64) MAPK8PTGER4PTGER2LMNAHPGD
SCHEMBL7168843 0.88 MAPK8 (0.72) MAPK8PTGER4
SCHEMBL7371983 0.88 MAPK8 (0.69) MAPK8PTGER4PTGER2LMNAHPGD
SCHEMBL7371783 0.88 KMT2A (0.63) MAPK8LMNAHPGDSMN1; SMN2
SCHEMBL7363675 0.87 MAPK8 (0.67) MAPK8PTGER4PTGER2LMNAHPGD
SCHEMBL7367297 0.87 MAPK8 (0.61) MAPK8LMNAHPGDSMN1; SMN2
SCHEMBL7375840 0.86 MAPK8 (0.64) MAPK8PTGER4LMNAHPGDSMN1; SMN2
SCHEMBL4087178 0.86 MAPK8 (0.69) MAPK8PTGER4LMNAHPGDSMN1; 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 4 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
CN-1254335-A Nicotinamide derivatives PFIZER PROD INC (US) 2000-05-24 CN 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