SCHEMBL6686255

SCHEMBL6686255

Cc1cc(F)cc(F)c1S(=O)(=O)Nc1ncc(CC(=O)N(C(C)C)C(C)C)s1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HSD11B1 P28845 1/20 0.37
PFKFB4 Q16877 1/20 0.34
SCN8A Q9UQD0 5/20 0.33
SCN9A Q15858 5/20 0.33
PSEN1 P49768 3/20 0.33
PSEN2 P49810 3/20 0.33
APH1B Q8WW43 3/20 0.33
NCSTN Q92542 3/20 0.33
APH1A Q96BI3 3/20 0.33
PSENEN Q9NZ42 3/20 0.33
SCN1A P35498 2/20 0.33
SCN5A Q14524 2/20 0.33
ALDH1A1 P00352 2/20 0.32
TSHR P16473 1/20 0.32
PIK3C3 Q8NEB9 1/20 0.32
NR1I2 O75469 2/20 0.32
CYP2D6 P10635 2/20 0.32
CYP2C9 P11712 2/20 0.32
OGA O60502 1/20 0.32
SMN1; SMN2 Q16637 2/20 0.31

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
SCHEMBL3252155 0.82 HSD11B1 (0.41) HSD11B1PFKFB4SCN8ASCN9AALDH1A1
SCHEMBL3252428 0.78 HSD11B1 (0.38) HSD11B1PFKFB4SCN8ASCN9APSEN1
SCHEMBL3255295 0.74 HSD11B1 (0.65) HSD11B1MEN1KMT2APOLB
SCHEMBL3254141 0.72 ALOX12 (0.44) ALDH1A1CYP2C9MEN1KMT2A
SCHEMBL3248288 0.71 AKT1 (0.45) ALDH1A1KDM4E
SCHEMBL3248368 0.70 HSD11B1 (0.41) HSD11B1ALDH1A1TSHRSMN1; SMN2MEN1
SCHEMBL3251004 0.69 HSD11B1 (0.40) HSD11B1ALDH1A1TSHRSMN1; SMN2MEN1
SCHEMBL3254728 0.68 MEP1B (0.46) HSD11B1ALDH1A1TSHRSMN1; SMN2KDM4E
SCHEMBL3258283 0.68 HSD11B1 (0.43) HSD11B1PFKFB4ALDH1A1TSHRMEN1
SCHEMBL3256136 0.68 PSEN1 (0.38) PFKFB4SCN8APSEN1PSEN2APH1B

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-1461325-A1 INHIBITORS OF 11-BETA-HYDROXY STEROID DEHYDROGENASE TYPE 1 BIOVITRUM AB (SE) 2004-09-29 EP claimed
WO-2003043999-A1 INHIBITORS OF 11-BETA-HYDROXY STEROID DEHYDROGENASE TYPE 1 BIOVITRUM AB (SE) 2003-05-30 WO claimed