SCHEMBL9825486

SCHEMBL9825486

O=C(c1ccccc1)C1CCN(C(=O)CN2CSCC2=O)CC1

nearest known ligand 0.53

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 5/20 0.53
MEN1 O00255 3/20 0.53
LMNA P02545 1/20 0.53
CPB1 P15086 1/20 0.50
ALDH1A1 P00352 2/20 0.47
MGLL Q99685 4/20 0.46
HSD11B1 P28845 1/20 0.46
HTR2A P28223 1/20 0.44
MAPT P10636 1/20 0.42
KCNH2 Q12809 1/20 0.42
HRH3 Q9Y5N1 1/20 0.42

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
SCHEMBL9826740 0.76 ALDH1A1 (0.55) KMT2AMEN1LMNAALDH1A1MAPT
SCHEMBL9825505 0.75 ALDH1A1 (0.60) KMT2AALDH1A1
SCHEMBL14294137 0.74 BLM (0.62) KMT2AMEN1LMNACPB1ALDH1A1
SCHEMBL9826774 0.73 PKM (0.39) ALDH1A1HTR2AKCNH2
SCHEMBL10674133 0.73 KDM4E (0.57) KMT2AALDH1A1HSD11B1
SCHEMBL6210602 0.72 L3MBTL1 (0.75) KMT2AMEN1LMNACPB1ALDH1A1
SCHEMBL2556107 0.71 CPB1 (0.67) KMT2AMEN1CPB1ALDH1A1MGLL
SCHEMBL9826656 0.71 POLB (0.39) KMT2ALMNAMAPT
SCHEMBL1720183 0.70 MGLL (0.82) KMT2AMEN1CPB1ALDH1A1MGLL
SCHEMBL10670461 0.70 CACNA2D1 (0.61) ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0203743-B1 OXOTHIAZOLIDINE COMPOUND FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1991-02-06 EP disclosed
US-4764514-A COGNITIONACTIVATORS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1988-08-16 US disclosed
EP-0203743-A1 Oxothiazolidine compound FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1986-12-03 EP disclosed