SCHEMBL4785243

SCHEMBL4785243

Cc1ccc(F)cc1S(=O)(=O)N1CCCC(CC(=O)NN2CCOCC2)C1

nearest known ligand 0.48

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
TP53 P04637 2/20 0.48
L3MBTL1 Q9Y468 2/20 0.47
ALDH1A1 P00352 3/20 0.47
KMT2A Q03164 3/20 0.47
MEN1 O00255 2/20 0.47
KDM4E B2RXH2 1/20 0.47
CYP19A1 P11511 1/20 0.47
CYP3A4 P08684 1/20 0.46
CYP2C19 P33261 1/20 0.46
CNR2 P34972 4/20 0.46
CNR1 P21554 3/20 0.46
NPC1 O15118 2/20 0.46
RAB9A P51151 1/20 0.46
LMNA P02545 1/20 0.43
MAPT P10636 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43

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
SCHEMBL4787027 0.93 CYP19A1 (0.55) TP53L3MBTL1ALDH1A1KMT2AMEN1
SCHEMBL4740145 0.91 MAPT (0.49) TP53ALDH1A1KMT2AKDM4ECYP19A1
SCHEMBL4738269 0.89 CYP3A4 (0.47) L3MBTL1ALDH1A1KMT2AMEN1KDM4E
SCHEMBL4738940 0.87 ALDH1A1 (0.53) ALDH1A1KMT2AMEN1KDM4ECYP19A1
SCHEMBL4740138 0.86 L3MBTL1 (0.46) L3MBTL1ALDH1A1KMT2AMEN1KDM4E
SCHEMBL4739749 0.86 CYP3A4 (0.63) TP53ALDH1A1KMT2AMEN1CYP19A1
SCHEMBL4736822 0.85 L3MBTL1 (0.45) L3MBTL1ALDH1A1KMT2AMEN1KDM4E
SCHEMBL4787735 0.83 CYP19A1 (0.58) TP53ALDH1A1KDM4ECYP19A1CYP3A4
SCHEMBL4808038 0.82 MAPT (0.48) L3MBTL1ALDH1A1KDM4ECYP3A4CYP2C19
SCHEMBL4786641 0.81 L3MBTL1 (0.49) L3MBTL1ALDH1A1KMT2AMEN1KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2008087654-A2 PIPERIDINES AS INHIBITORS OF 11β-HYDROXYSTEROID DEHYDROGENASE TYPE 1 CADILA HEALTHCARE LIMITED (IN) 2008-07-24 WO disclosed