SCHEMBL7021073

SCHEMBL7021073

CCCCC(CC)COc1ccc(-c2nc(-c3ccc(OCC(CC)CCCC)cc3O)nc(-c3ccccc3OC)n2)c(O)c1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 7/20 0.45
KMT2A Q03164 7/20 0.45
MAPK1 P28482 5/20 0.45
LMNA P02545 5/20 0.45
TP53 P04637 4/20 0.45
ALOX12 P18054 4/20 0.45
ALDH1A1 P00352 4/20 0.45
HTT P42858 2/20 0.45
HSD17B10 Q99714 2/20 0.45
HPGD P15428 1/20 0.45
ALOX15 P16050 1/20 0.45
LRRK2 Q5S007 1/20 0.45
ATM Q13315 1/20 0.44
MAPT P10636 9/20 0.41
NPSR1 Q6W5P4 6/20 0.41
KDM4E B2RXH2 3/20 0.41
POLB P06746 1/20 0.41
TSHR P16473 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
USP2 O75604 1/20 0.40

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
SCHEMBL20024329 0.98 KMT2A (0.44) MEN1KMT2AMAPK1LMNATP53
SCHEMBL8866441 0.94 LMNA (0.41) MEN1KMT2AMAPK1LMNATP53
SCHEMBL7217044 0.89 LMNA (0.42) MEN1KMT2AMAPK1LMNAALDH1A1
SCHEMBL20024345 0.87 LMNA (0.41) MEN1KMT2AMAPK1LMNATP53
SCHEMBL14070539 0.87 NPC1 (0.40) MEN1KMT2AMAPK1LMNATP53
SCHEMBL27861746 0.86 LMNA (0.42) MEN1KMT2AMAPK1LMNATP53
SCHEMBL6031655 0.86 LMNA (0.41) MEN1KMT2AMAPK1LMNATP53
SCHEMBL1290508 0.86 LMNA (0.42) MEN1KMT2AMAPK1LMNATP53
SCHEMBL29120353 0.86 LMNA (0.42) MEN1KMT2AMAPK1LMNATP53
SCHEMBL28638598 0.86 LMNA (0.40) MEN1KMT2AMAPK1LMNAALDH1A1

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3093008-B1 OCTOCRYLENE-FREE SUNSCREEN AGENT CONTAINING DIETHYLAMINOHYDROXYBENZ OYLHEXYLBENZOATE BEIERSDORF AG (DE) 2019-07-17 EP claimed
EP-1280505-A1 PHOTOSTABILIZATION OF DIBENZOYLMETHANE DERIVATIVES Ciba SC Holding AG (CH) 2003-02-05 EP disclosed
WO-2001085123-A1 PHOTOSTABILIZATION OF DIBENZOYLMETHANE DERIVATIVES CIBA SPECIALTY CHEMICALS HOLDING INC. (CH) 2001-11-15 WO disclosed