SCHEMBL6274192

SCHEMBL6274192

CCOC(=O)c1cc(S(=O)(=O)c2ccc(CCNC(Cc3ccccc3)[C@H](O)c3ccc(C)nc3)cc2)ccc1OCc1ccccc1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 3/20 0.37
KMT2A Q03164 3/20 0.37
SMN1; SMN2 Q16637 2/20 0.37
GAA P10253 1/20 0.37
TP53 P04637 3/20 0.37
NPSR1 Q6W5P4 2/20 0.37
LRRK2 Q5S007 2/20 0.37
KDM4E B2RXH2 1/20 0.37
ALDH1A1 P00352 1/20 0.37
LMNA P02545 1/20 0.37
ALOX15 P16050 1/20 0.37
TSHR P16473 1/20 0.37
MAPK1 P28482 1/20 0.37
HTT P42858 1/20 0.37
PPP1CA P62136 1/20 0.37
HSD17B10 Q99714 1/20 0.37
HSP90AA1 P07900 1/20 0.37
PPIA P62937 1/20 0.36
MAPT P10636 2/20 0.36
NMT1 P30419 2/20 0.36

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
SCHEMBL6270665 0.93 LRRK2 (0.39) MEN1KMT2ASMN1; SMN2GAALRRK2
SCHEMBL6271193 0.91 KMT2A (0.41) MEN1KMT2ASMN1; SMN2GAALRRK2
SCHEMBL6272458 0.86 NLRP3 (0.40) MEN1KMT2ASMN1; SMN2GAALRRK2
SCHEMBL6269042 0.83 AKR1C3 (0.39) KMT2ASMN1; SMN2GAALRRK2ALDH1A1
SCHEMBL6272705 0.83 LRRK2 (0.39) MEN1KMT2ASMN1; SMN2GAALRRK2
SCHEMBL6272989 0.82 GAA (0.38) MEN1KMT2ASMN1; SMN2GAALRRK2
SCHEMBL6274200 0.81 LRRK2 (0.37) MEN1KMT2ANPSR1LRRK2ALDH1A1
SCHEMBL6274196 0.81 LRRK2 (0.37) MEN1KMT2ANPSR1LRRK2ALDH1A1
SCHEMBL6272979 0.80 POLB (0.41) MEN1KMT2ASMN1; SMN2ALDH1A1LMNA
SCHEMBL6273572 0.80 AKR1C3 (0.39) KMT2ASMN1; SMN2GAALRRK2NAMPT

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-2005110981-A1 AMINOALCOHOL DERIVATIVES ASTELLAS PHARMA INC. (JP) 2005-11-24 WO disclosed