SCHEMBL6474715

SCHEMBL6474715

CCCCC1CN(OCc2ccccc2)C1=O

nearest known ligand 0.45

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.44
TSHR P16473 1/20 0.41
CYP3A4 P08684 2/20 0.41
GRM2 Q14416 1/20 0.41
LMNA P02545 1/20 0.41
CYP1A2 P05177 1/20 0.41
CYP2C9 P11712 1/20 0.41
MAPK1 P28482 1/20 0.41
CYP2C19 P33261 1/20 0.41
TP53 P04637 1/20 0.41
MAPT P10636 1/20 0.41
HPGD P15428 1/20 0.41
PTGS1 P23219 1/20 0.41
RAB9A P51151 1/20 0.41
NAPRT Q6XQN6 1/20 0.41
PREP P48147 1/20 0.41
MEN1 O00255 1/20 0.38
KMT2A Q03164 1/20 0.38
CETP P11597 1/20 0.38

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
SCHEMBL4317709 1.00 ALDH1A1 (0.44) ALDH1A1TSHRCYP3A4GRM2LMNA
SCHEMBL4314804 1.00 ALDH1A1 (0.44) ALDH1A1TSHRCYP3A4GRM2LMNA
SCHEMBL134600 0.96 ALDH1A1 (0.43) ALDH1A1TSHRGRM2PREPMEN1
SCHEMBL131142 0.96 ALDH1A1 (0.43) ALDH1A1TSHRGRM2PREPMEN1
SCHEMBL27449506 0.93 ALDH1A1 (0.45) ALDH1A1TSHRPREPMEN1KMT2A
SCHEMBL16898052 0.85 ALDH1A1 (0.43) ALDH1A1TSHRPREP
SCHEMBL16898055 0.85 ALDH1A1 (0.43) ALDH1A1TSHRPREP
SCHEMBL3945465 0.83 FAAH (0.41) ALDH1A1PREPKMT2A
SCHEMBL14028930 0.77 ALDH1A1 (0.50) ALDH1A1TSHRGRM2PREPMEN1
SCHEMBL14028937 0.77 ALDH1A1 (0.50) ALDH1A1TSHRGRM2PREPMEN1

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7589216-B2 Process for preparing N-hydroxyformamido-propyl pyrrolidin compounds and intermediates NOVARTIS AG (CH) 2009-09-15 US disclosed
US-7589216-B2 Process for preparing N-hydroxyformamido-propyl pyrrolidin compounds and intermediates NOVARTIS AG (CH) 2009-09-15 US disclosed
EP-1542968-B1 PROCESS FOR PREPARING INTERMEDIATES NOVARTIS AG (CH) 2008-12-17 EP disclosed
EP-1599440-A2 CHEMICAL PROCESS FOR THE PREPARATION OF INTERMEDIATES TO OBTAIN N-FORMYL HYDROXYLAMINE COMPOUNDS Novartis AG (CH) 2005-11-30 EP disclosed
WO-2004076053-A2 CHEMICAL PROCESS FOR THE PREPARATION OF INTERMEDIATES TO OBTAIN N-FORMYL HYDROXYLAMINE COMPOUNDS NOVARTIS AG (CH) 2004-09-10 WO disclosed