SCHEMBL4067111

SCHEMBL4067111

CCCCCCCCCc1ccc(OCCOCCOCCOCCOC)cc1

nearest known ligand 0.76

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.76
LMNA P02545 2/20 0.76
CYP3A4 P08684 2/20 0.76
MEN1 O00255 1/20 0.76
USP2 O75604 1/20 0.76
MAPK1 P28482 1/20 0.76
CASP1 P29466 1/20 0.76
KMT2A Q03164 1/20 0.76
SMN1; SMN2 Q16637 1/20 0.76
SLCO1B3 Q9NPD5 1/20 0.76
SLCO1B1 Q9Y6L6 1/20 0.76
KDM4E B2RXH2 2/20 0.48
RECQL P46063 1/20 0.48
NR5A1 Q13285 1/20 0.47
PLA2G4A P47712 1/20 0.47
S1PR1 P21453 4/20 0.47
S1PR4 O95977 3/20 0.46
S1PR5 Q9H228 3/20 0.46
S1PR3 Q99500 2/20 0.46
S1PR2 O95136 1/20 0.46

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
SCHEMBL28975665 1.00 ALDH1A1 (0.76) ALDH1A1LMNACYP3A4MEN1USP2
SCHEMBL9610966 0.95 ALDH1A1 (0.68) ALDH1A1LMNACYP3A4MEN1USP2
SCHEMBL11254222 0.94 ALDH1A1 (0.85) ALDH1A1LMNACYP3A4MEN1USP2
SCHEMBL10002248 0.91 MEN1 (0.64) ALDH1A1LMNACYP3A4MEN1USP2
SCHEMBL27459344 0.90 ALDH1A1 (0.80) ALDH1A1LMNACYP3A4MEN1USP2
SCHEMBL19916789 0.90 LMNA (0.80) ALDH1A1LMNACYP3A4MEN1USP2
SCHEMBL28847344 0.90 ALDH1A1 (0.80) ALDH1A1LMNACYP3A4MEN1USP2
SCHEMBL15294293 0.90 LMNA (0.80) ALDH1A1LMNACYP3A4MEN1USP2
SCHEMBL17577214 0.89 ALDH1A1 (0.78) ALDH1A1LMNACYP3A4MEN1USP2
SCHEMBL16991894 0.89 ALDH1A1 (0.78) ALDH1A1LMNACYP3A4MEN1USP2

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-20120103220-A1 LITHOGRAPHIC PRINTING PLATE PRECURSOR SONOKAWA KOJI (JP) 2012-05-03 US disclosed