SCHEMBL8301733

SCHEMBL8301733

CCOC(=O)c1cccc(NS(=O)(=O)C(C)C)c1

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 5/20 0.60
LMNA P02545 2/20 0.60
NPSR1 Q6W5P4 1/20 0.57
POLB P06746 3/20 0.56
ALDH1A1 P00352 3/20 0.55
KMT2A Q03164 2/20 0.55
TSHR P16473 1/20 0.55
RAB9A P51151 5/20 0.54
NPC1 O15118 4/20 0.54
KDM4E B2RXH2 1/20 0.54
CYP1A2 P05177 1/20 0.53
CYP2C9 P11712 1/20 0.53
HPGD P15428 1/20 0.53
CYP2C19 P33261 1/20 0.53
PKM P14618 1/20 0.53
CA12 O43570 1/20 0.53
CA1 P00915 1/20 0.53
CA2 P00918 1/20 0.53
CA9 Q16790 1/20 0.53
MAPT P10636 4/20 0.52

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
SCHEMBL31317790 0.86 POLB (0.70) SMN1; SMN2POLBALDH1A1KMT2ARAB9A
SCHEMBL4191490 0.86 POLB (0.70) SMN1; SMN2POLBALDH1A1KMT2ARAB9A
SCHEMBL4823240 0.85 HPGD (0.68) SMN1; SMN2LMNANPSR1POLBALDH1A1
SCHEMBL3560486 0.85 POLB (0.73) SMN1; SMN2LMNAPOLBALDH1A1KMT2A
SCHEMBL134028 0.84 SMN1; SMN2 (0.58) SMN1; SMN2LMNANPSR1POLBALDH1A1
SCHEMBL134279 0.83 SMN1; SMN2 (0.62) SMN1; SMN2LMNANPSR1POLBALDH1A1
SCHEMBL27183334 0.82 SMN1; SMN2 (0.65) SMN1; SMN2LMNANPSR1POLBALDH1A1
SCHEMBL856142 0.81 SMN1; SMN2 (0.60) SMN1; SMN2LMNAPOLBALDH1A1KMT2A
SCHEMBL396078 0.80 NPSR1 (0.62) SMN1; SMN2LMNANPSR1POLBALDH1A1
SCHEMBL1726857 0.80 LMNA (0.76) SMN1; SMN2LMNAPOLBKMT2ATSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1651641-B1 NICOTINAMIDE DERIVATIVES USEFUL AS PDE4 INHIBITORS PFIZER LTD (GB) 2007-05-23 EP disclosed
WO-2005009995-A1 NICOTINAMIDE DERIVATIVES USEFUL AS PDE4 INHIBITORS PFIZER LIMITED (GB) 2005-02-03 WO disclosed