SCHEMBL10833045

SCHEMBL10833045

CN(C)C(=NC=O)c1nc(CCl)cs1

nearest known ligand 0.42

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 3/20 0.42
KMT2A Q03164 1/20 0.42
RAB9A P51151 4/20 0.37
NPC1 O15118 3/20 0.37
ALDH1A1 P00352 6/20 0.35
TDP1 Q9NUW8 4/20 0.35
MAPT P10636 3/20 0.34
LMNA P02545 2/20 0.34
GFER P55789 2/20 0.34
HPGD P15428 1/20 0.34
KDM4E B2RXH2 4/20 0.33
GAA P10253 2/20 0.33
POLB P06746 1/20 0.33
L3MBTL1 Q9Y468 1/20 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
SCHEMBL10832537 0.86 SMN1; SMN2 (0.40) SMN1; SMN2KMT2ARAB9ANPC1ALDH1A1
SCHEMBL10831790 0.78 ACHE (0.34) MAPTLMNA
SCHEMBL4886906 0.75 SMN1; SMN2 (0.49) SMN1; SMN2KMT2ARAB9ANPC1ALDH1A1
SCHEMBL10832464 0.72 HRH2 (0.40) KMT2AALDH1A1MAPTLMNA
SCHEMBL5988033 0.70 SMN1; SMN2 (0.49) SMN1; SMN2KMT2ARAB9ANPC1ALDH1A1
SCHEMBL855213 0.70 SMN1; SMN2 (0.57) SMN1; SMN2KMT2ARAB9ANPC1ALDH1A1
SCHEMBL4890454 0.68 SMN1; SMN2 (0.50) SMN1; SMN2KMT2ARAB9ANPC1ALDH1A1
SCHEMBL1118859 0.68 SMN1; SMN2 (0.50) SMN1; SMN2KMT2ARAB9ANPC1ALDH1A1
SCHEMBL10833142 0.66 SLC22A2 (0.32) KMT2AALDH1A1LMNAPOLB
SCHEMBL14825340 0.66 SMN1; SMN2 (0.53) SMN1; SMN2KMT2ARAB9ANPC1ALDH1A1

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
US-4578478-A Thiazole derivatives and procedure of synthesis thereof KOTOBUKI SEIYAKU COMPANY LIMITED (JP) 1986-03-25 US disclosed