SCHEMBL16677971

SCHEMBL16677971

COc1cc(C(=O)NNC(=O)c2cc(C(=O)NNC(=O)c3cc(OC)c(OC)c(OC)c3)cc(C(=O)NNC(=O)c3cc(OC)c(OC)c(OC)c3)c2)cc(OC)c1OC

nearest known ligand 0.67

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.67
SIRT5 Q9NXA8 1/20 0.67
LMNA P02545 4/20 0.63
POLB P06746 2/20 0.63
MEN1 O00255 2/20 0.62
KMT2A Q03164 2/20 0.62
SMN1; SMN2 Q16637 3/20 0.60
ALDH1A1 P00352 3/20 0.58
KDM4E B2RXH2 3/20 0.58
GAA P10253 1/20 0.58
MAPK1 P28482 1/20 0.58
HPGD P15428 1/20 0.57
ABCB1 P08183 1/20 0.57
APOBEC3A P31941 1/20 0.56
APOBEC3G Q9HC16 1/20 0.56

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
SCHEMBL10567476 0.91 MAPT (0.61) MAPTSIRT5LMNAPOLBMEN1
SCHEMBL24497711 0.88 ALDH1A1 (0.59) MAPTSIRT5LMNAPOLBMEN1
SCHEMBL22510104 0.86 ALDH1A1 (0.58) MAPTSIRT5LMNAPOLBMEN1
SCHEMBL4143482 0.84 ALDH1A1 (0.77) MAPTSIRT5LMNAPOLBMEN1
SCHEMBL1437082 0.84 MEN1 (0.62) MAPTSIRT5LMNAPOLBMEN1
SCHEMBL6497794 0.82 MEN1 (0.60) MAPTSIRT5LMNAPOLBMEN1
SCHEMBL2451128 0.82 ALDH1A1 (0.66) POLBMEN1KMT2ASMN1; SMN2ALDH1A1
SCHEMBL26348677 0.82 MEN1 (0.60) MAPTSIRT5LMNAPOLBMEN1
SCHEMBL16675167 0.82 ABCB1 (0.68) MAPTLMNAPOLBMEN1KMT2A
SCHEMBL12387924 0.81 KDM4E (0.63) MAPTLMNAPOLBMEN1KMT2A

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-20150114257-A1 METHOD OF PREPARING RETARDATION FILM, POLARIZING PLATE, AND LIQUID CRYSTAL DISPLAY Konica Minolta, Inc. (JP) 2015-04-30 US disclosed