SCHEMBL7403761

SCHEMBL7403761

CCOC(=O)C1CCC(CNC(=O)OCc2ccccc2)CC1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.54
KMT2A Q03164 2/20 0.54
ALDH1A1 P00352 3/20 0.50
GAA P10253 1/20 0.50
MAPT P10636 2/20 0.48
TSHR P16473 2/20 0.48
PKM P14618 1/20 0.48
NPSR1 Q6W5P4 1/20 0.48
CYP1A2 P05177 2/20 0.47
CYP3A4 P08684 2/20 0.47
CYP2D6 P10635 2/20 0.47
CYP2C9 P11712 2/20 0.47
CYP2C19 P33261 2/20 0.47
TAS2R14 Q9NYV8 3/20 0.47
LMNA P02545 2/20 0.47
GNRHR P30968 1/20 0.46
F13A1 P00488 1/20 0.46
TGM2 P21980 1/20 0.46
TGM1 P22735 1/20 0.46
SMN1; SMN2 Q16637 1/20 0.46

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
SCHEMBL7403759 1.00 MEN1 (0.54) MEN1KMT2AALDH1A1GAAMAPT
SCHEMBL6350370 0.90 ALDH1A1 (0.52) MEN1KMT2AALDH1A1GAAMAPT
SCHEMBL17891887 0.89 ALDH1A1 (0.48) MEN1KMT2AALDH1A1GAAMAPT
SCHEMBL17891888 0.89 ALDH1A1 (0.48) MEN1KMT2AALDH1A1GAAMAPT
SCHEMBL9408501 0.88 ALDH1A1 (0.50) MEN1KMT2AALDH1A1GAAMAPT
SCHEMBL8393648 0.87 LMNA (0.58) MEN1KMT2AALDH1A1GAAMAPT
SCHEMBL6483798 0.86 ALDH1A1 (0.53) MEN1KMT2AALDH1A1GAAMAPT
SCHEMBL6483802 0.86 ALDH1A1 (0.53) MEN1KMT2AALDH1A1GAAMAPT
SCHEMBL594857 0.86 ALDH1A1 (0.67) MEN1KMT2AALDH1A1GAAMAPT
SCHEMBL594858 0.86 ALDH1A1 (0.67) MEN1KMT2AALDH1A1GAAMAPT

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