SCHEMBL11215371

SCHEMBL11215371

CCCOC(C)c1nnc(NC(=O)N(C)CC(OC)OC)s1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ SMN1; SMN2 Q16637 5/20 0.42
▸ NPC1 O15118 4/20 0.42
▸ RAB9A P51151 4/20 0.42
▸ LMNA P02545 3/20 0.39
▸ ALDH1A1 P00352 9/20 0.38
▸ MAPT P10636 3/20 0.38
▸ HPGD P15428 3/20 0.35
▸ MEN1 O00255 2/20 0.35
▸ KMT2A Q03164 2/20 0.35
▸ APOBEC3G Q9HC16 1/20 0.35
▸ TP53 P04637 2/20 0.35
▸ ALOX15 P16050 1/20 0.35
▸ TSHR P16473 3/20 0.34
▸ GLA P06280 1/20 0.34
▸ L3MBTL1 Q9Y468 2/20 0.34
▸ USP2 O75604 1/20 0.34
▸ CYP1A2 P05177 1/20 0.33
▸ CYP2C9 P11712 1/20 0.33
▸ CYP2C19 P33261 1/20 0.33
▸ HSD17B10 Q99714 1/20 0.33

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
SCHEMBL11214313 0.88 SMN1; SMN2 (0.41) SMN1; SMN2NPC1RAB9ALMNAALDH1A1
SCHEMBL11216906 0.85 SMN1; SMN2 (0.39) SMN1; SMN2NPC1RAB9ALMNAALDH1A1
SCHEMBL11398951 0.81 ALDH1A1 (0.46) SMN1; SMN2NPC1RAB9ALMNAALDH1A1
SCHEMBL11294057 0.80 KMT2A (0.41) SMN1; SMN2NPC1RAB9ALMNAALDH1A1
SCHEMBL11393669 0.79 MAPT (0.40) SMN1; SMN2NPC1RAB9ALMNAALDH1A1
SCHEMBL11361043 0.79 ALDH1A1 (0.36) SMN1; SMN2NPC1RAB9ALMNAALDH1A1
SCHEMBL11293028 0.78 NPC1 (0.43) SMN1; SMN2NPC1RAB9ALMNAALDH1A1
SCHEMBL11293133 0.77 ALDH1A1 (0.44) SMN1; SMN2NPC1RAB9ALMNAALDH1A1
SCHEMBL11296286 0.77 NPC1 (0.42) SMN1; SMN2NPC1RAB9ALMNAALDH1A1
SCHEMBL11356315 0.77 SMN1; SMN2 (0.42) SMN1; SMN2NPC1RAB9ALMNAALDH1A1

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-4314842-A Herbicidal substituted 1,3,4-thiadiazol-2-yl-4-hydroxy-1-methyl-2-imidazolidinones PPG INDUSTRIES, INC. (US) 1982-02-09 — — US disclosed
Send feedback