SCHEMBL15906309

SCHEMBL15906309

CC(=O)c1ccc2c(c1)c1cc([N+](=O)[O-])ccc1n2C

nearest known ligand 0.64

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MAPT P10636 8/20 0.64
MAPK1 P28482 2/20 0.56
ALDH1A1 P00352 2/20 0.54
GAA P10253 1/20 0.51
MEN1 O00255 5/20 0.48
KMT2A Q03164 5/20 0.48
LMNA P02545 4/20 0.48
SMN1; SMN2 Q16637 2/20 0.48
F2R P25116 1/20 0.48
NPSR1 Q6W5P4 1/20 0.48
F2RL3 Q96RI0 1/20 0.48
POLB P06746 1/20 0.47
ATM Q13315 1/20 0.47
KDM4E B2RXH2 1/20 0.47
EGFR P00533 1/20 0.46
SRC P12931 1/20 0.46
NPC1 O15118 1/20 0.46
AKR1C3 P42330 1/20 0.44
AKR1C2 P52895 1/20 0.44

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
SCHEMBL30600488 0.86 MAPT (0.83) MAPTALDH1A1MEN1KMT2ALMNA
SCHEMBL155568 0.86 MAPT (0.83) MAPTALDH1A1MEN1KMT2ALMNA
SCHEMBL16093633 0.85 MAPT (0.54) MAPTMAPK1ALDH1A1GAAMEN1
SCHEMBL15906326 0.85 MAPT (0.59) MAPTALDH1A1GAAMEN1KMT2A
SCHEMBL28121877 0.84 KDM4E (0.61) MAPTALDH1A1LMNASMN1; SMN2NPSR1
SCHEMBL15906325 0.82 MAPT (0.53) MAPTMAPK1ALDH1A1GAAMEN1
SCHEMBL28500351 0.81 MAPT (0.49) MAPTMAPK1ALDH1A1MEN1KMT2A
SCHEMBL4062222 0.81 MAPT (0.50) MAPTMAPK1ALDH1A1MEN1KMT2A
SCHEMBL15906317 0.79 MAPT (0.60) MAPTALDH1A1GAAMEN1KMT2A
SCHEMBL28349286 0.78 MAPT (0.42) MAPTMAPK1ALDH1A1GAASMN1; SMN2

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-2397903-B1 PHOTOACTIVE COMPOUND AND PHOTOSENSITIVE RESIN COMPOSITION CONTAINING THE SAME LG CHEMICAL LTD (KR) 2014-07-30 EP disclosed