SCHEMBL17547183

SCHEMBL17547183

CCCCc1ccc(OCCOC(C)C)cc1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.54
SMN1; SMN2 Q16637 2/20 0.54
MEN1 O00255 1/20 0.54
USP2 O75604 1/20 0.54
ALDH1A1 P00352 1/20 0.54
CYP3A4 P08684 1/20 0.54
MAPK1 P28482 1/20 0.54
CASP1 P29466 1/20 0.54
KMT2A Q03164 1/20 0.54
SLCO1B3 Q9NPD5 1/20 0.54
SLCO1B1 Q9Y6L6 1/20 0.54
L3MBTL1 Q9Y468 1/20 0.44
HRH3 Q9Y5N1 1/20 0.44
LTA4H P09960 1/20 0.43
KDM4E B2RXH2 1/20 0.43
CYP1A2 P05177 1/20 0.43
CYP2D6 P10635 1/20 0.43
PDE4A P27815 1/20 0.43
HIF1A Q16665 1/20 0.43
HDAC10 Q969S8 1/20 0.43

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
SCHEMBL14443353 0.95 MEN1 (0.60) LMNASMN1; SMN2MEN1USP2ALDH1A1
SCHEMBL14443351 0.94 ALDH1A1 (0.62) LMNASMN1; SMN2MEN1USP2ALDH1A1
SCHEMBL14443363 0.86 NR5A1 (0.56) LMNALTA4HTSHR
SCHEMBL16933991 0.86 LMNA (0.62) LMNASMN1; SMN2MEN1USP2ALDH1A1
SCHEMBL14443359 0.84 NR5A1 (0.59) LMNALTA4HTSHR
SCHEMBL17935503 0.84 CYP3A4 (0.50) LMNASMN1; SMN2MEN1USP2ALDH1A1
SCHEMBL14117316 0.82 HPGD (0.50) LMNASMN1; SMN2ALDH1A1HRH3KDM4E
SCHEMBL19043546 0.82 MEN1 (0.63) LMNASMN1; SMN2MEN1USP2ALDH1A1
SCHEMBL18896254 0.82 LMNA (0.61) LMNASMN1; SMN2MEN1USP2ALDH1A1
SCHEMBL682704 0.81 MEN1 (0.56) LMNASMN1; SMN2MEN1USP2ALDH1A1

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
EP-2990873-A1 PROCESS FOR MAKING LITHOGRAPHIC PRINTING PLATE Fujifilm Corporation (JP) 2016-03-02 EP disclosed