SCHEMBL13014111

SCHEMBL13014111

CC(=O)OCc1ccc(C(=O)N(N)C(=O)c2ccc(-c3ccccc3)cc2)cc1

nearest known ligand 0.57

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.57
MAPT P10636 5/20 0.48
HPGD P15428 4/20 0.48
RAB9A P51151 2/20 0.47
NPC1 O15118 1/20 0.47
SMN1; SMN2 Q16637 3/20 0.44
MEN1 O00255 2/20 0.44
KMT2A Q03164 2/20 0.44
TP53 P04637 1/20 0.44
PTGES O14684 1/20 0.44
ALOX5 P09917 1/20 0.44
IDO1 P14902 2/20 0.42
AGXT P21549 2/20 0.42
KDM4E B2RXH2 1/20 0.42
ATR Q13535 1/20 0.42
GAA P10253 1/20 0.42

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
SCHEMBL487227 0.85 ALDH1A1 (0.78) ALDH1A1MAPTRAB9ANPC1SMN1; SMN2
SCHEMBL3082525 0.81 RAB9A (0.62) ALDH1A1MAPTHPGDRAB9ANPC1
Biphenyl SCHEMBL11403488 0.80 ALDH1A1 (0.88) ALDH1A1MAPTHPGDRAB9ANPC1
SCHEMBL14063398 0.80 ALDH1A1 (0.64) ALDH1A1MAPTHPGDRAB9ANPC1
SCHEMBL14063393 0.80 ALDH1A1 (0.64) ALDH1A1MAPTHPGDRAB9ANPC1
SCHEMBL9581057 0.80 ALDH1A1 (0.64) ALDH1A1MAPTHPGDRAB9ANPC1
SCHEMBL20326231 0.79 ALDH1A1 (0.61) ALDH1A1MAPTRAB9ANPC1SMN1; SMN2
SCHEMBL4198688 0.78 ALDH1A1 (0.69) ALDH1A1MAPTRAB9ANPC1MEN1
E1501 SCHEMBL901210 0.75 ALDH1A1 (1.00) ALDH1A1MAPTHPGDRAB9ANPC1
E1501 SCHEMBL14031569 0.75 ALDH1A1 (1.00) ALDH1A1MAPTHPGDRAB9ANPC1

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-2258804-A2 Polymers for use in optical devices Cambridge Display Technology Limited (GB) 2010-12-08 EP disclosed