SCHEMBL3729302

SCHEMBL3729302

CC(=O)Oc1ccc(S(=O)(=O)N(C)C)cc1

nearest known ligand 0.67

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.67
POLB P06746 2/20 0.67
PKM P14618 1/20 0.67
ALDH1A1 P00352 6/20 0.63
LMNA P02545 5/20 0.63
SMN1; SMN2 Q16637 4/20 0.63
HTT P42858 1/20 0.63
MEN1 O00255 2/20 0.50
KMT2A Q03164 2/20 0.50
PTGS2 P35354 1/20 0.48
KDM4E B2RXH2 1/20 0.46
TTR P02766 1/20 0.46
TP53 P04637 1/20 0.46
CYP3A4 P08684 1/20 0.46
ELANE P08246 1/20 0.46
TSHR P16473 1/20 0.46
NPY2R P49146 1/20 0.45
HSD17B10 Q99714 2/20 0.44
RAB9A P51151 1/20 0.44

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
SCHEMBL11771545 0.84 RAB9A (0.68) MAPTPOLBPKMALDH1A1LMNA
SCHEMBL3275099 0.83 ALDH1A1 (0.56) MAPTPOLBPKMALDH1A1LMNA
SCHEMBL30259514 0.81 ELANE (0.70) MAPTALDH1A1LMNASMN1; SMN2HTT
SCHEMBL9343618 0.80 PKM (1.00) MAPTPOLBPKMALDH1A1LMNA
SCHEMBL14024262 0.80 MAPT (0.77) MAPTPOLBPKMALDH1A1LMNA
SCHEMBL10628554 0.79 ALDH1A1 (0.59) MAPTPOLBPKMALDH1A1LMNA
SCHEMBL1930857 0.79 MAPT (0.74) MAPTPOLBPKMALDH1A1LMNA
SCHEMBL3161812 0.79 MAPT (0.74) MAPTPOLBPKMALDH1A1LMNA
SCHEMBL3372297 0.77 ALDH1A1 (0.58) MAPTPOLBPKMALDH1A1LMNA
SCHEMBL23651810 0.77 MAPT (0.76) MAPTALDH1A1LMNASMN1; SMN2HTT

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-2173715-A2 USE OF PIPERIDINE DERIVATIVES AS AGONISTS OF CHEMOKINE RECEPTOR ACTIVITY Euroscreen S.A. (BE) 2010-04-14 EP disclosed
WO-2009010478-A2 USE OF PIPERIDINE DERIVATIVES AS AGONISTS OF CHEMOKINE RECEPTOR ACTIVITY EUROSCREEN S.A. (BE) 2009-01-22 WO disclosed