SCHEMBL11548618

SCHEMBL11548618

CCOC(C)(C)CCCC(C)CCOc1ccc(CSC)cc1

nearest known ligand 0.36

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 1/20 0.36
NPC1 O15118 2/20 0.34
LMNA P02545 2/20 0.34
RAB9A P51151 2/20 0.34
SMN1; SMN2 Q16637 2/20 0.34
CYP2C19 P33261 2/20 0.34
S1PR4 O95977 1/20 0.33
S1PR1 P21453 1/20 0.33
S1PR3 Q99500 1/20 0.33
S1PR5 Q9H228 1/20 0.33
ACACB O00763 1/20 0.33
KDM4E B2RXH2 1/20 0.33
ALDH1A1 P00352 1/20 0.33
POLB P06746 1/20 0.33
CYP2C9 P11712 1/20 0.33
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33
TDP1 Q9NUW8 1/20 0.32

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
SCHEMBL11545630 0.89 LMNA (0.35) ALOX5NPC1LMNARAB9ASMN1; SMN2
SCHEMBL11553217 0.88 LMNA (0.40) ALOX5LMNASMN1; SMN2S1PR4S1PR1
SCHEMBL11547888 0.86 POLB (0.41) NPC1LMNASMN1; SMN2KDM4EALDH1A1
SCHEMBL11548607 0.85 MAPT (0.38) ALOX5LMNASMN1; SMN2KDM4EALDH1A1
SCHEMBL11549696 0.85 ALDH1A1 (0.38) ALOX5SMN1; SMN2S1PR4S1PR1S1PR3
SCHEMBL11552464 0.84 S1PR1 (0.43) LMNASMN1; SMN2S1PR4S1PR1S1PR3
SCHEMBL11714406 0.83 FDPS (0.35) ALOX5LMNASMN1; SMN2POLBMEN1
SCHEMBL11553386 0.83 HRH3 (0.40) LMNARAB9ASMN1; SMN2KDM4EALDH1A1
SCHEMBL11546267 0.83 MEN1 (0.41) NPC1RAB9ASMN1; SMN2KDM4EMEN1
SCHEMBL11546614 0.82 KDM4E (0.35) LMNASMN1; SMN2S1PR1KDM4EALDH1A1

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-4137273-A INSECTICIDES, CHEMICAL INTERMEDIATES ZOECON CORPORATION (US) 1979-01-30 US disclosed