SCHEMBL4739879

SCHEMBL4739879

Cc1ccc(S(=O)(=O)N2CCCC(CC(=O)NN3CCCCC3)C2)cc1Cl

nearest known ligand 0.58

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 1/20 0.58
GAA P10253 2/20 0.54
HTT P42858 2/20 0.54
MAPT P10636 6/20 0.52
ALDH1A1 P00352 4/20 0.51
LMNA P02545 2/20 0.51
USP2 O75604 1/20 0.51
NPSR1 Q6W5P4 1/20 0.51
MEN1 O00255 2/20 0.49
KMT2A Q03164 2/20 0.49
KDM4E B2RXH2 1/20 0.49
TDP1 Q9NUW8 2/20 0.49
TP53 P04637 3/20 0.48
POLB P06746 2/20 0.48
MITF O75030 1/20 0.47
PAX8 Q06710 1/20 0.47
SMN1; SMN2 Q16637 1/20 0.47

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
SCHEMBL4740459 0.92 ALDH1A1 (0.51) RAB9AGAAMAPTALDH1A1LMNA
SCHEMBL4741097 0.92 ALDH1A1 (0.51) RAB9AGAAMAPTALDH1A1LMNA
SCHEMBL4740197 0.89 LMNA (0.50) RAB9AMAPTALDH1A1LMNAMEN1
SCHEMBL4740901 0.89 CYP19A1 (0.58) RAB9AGAAHTTMAPTALDH1A1
SCHEMBL4740383 0.88 SMN1; SMN2 (0.58) RAB9AGAAHTTALDH1A1LMNA
SCHEMBL4739860 0.86 ALDH1A1 (0.55) RAB9AGAAALDH1A1MEN1KMT2A
SCHEMBL4738964 0.86 POLB (0.51) GAAHTTMAPTALDH1A1LMNA
SCHEMBL4741708 0.85 ALDH1A1 (0.56) RAB9AGAAALDH1A1MEN1KMT2A
SCHEMBL4740191 0.84 ALDH1A1 (0.55) GAAHTTMAPTALDH1A1LMNA
SCHEMBL4786793 0.84 CNR1 (0.47) MAPTALDH1A1LMNAPOLB

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