SCHEMBL9655941

SCHEMBL9655941

C=CN(C=C)C1(N(C=C)C=C)C=CC(C(=O)c2ccccc2)C=C1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AKT1 P31749 1/20 0.38
POLB P06746 1/20 0.35
GAA P10253 1/20 0.35
HSD17B10 Q99714 1/20 0.35
HTT P42858 2/20 0.34
MAPT P10636 1/20 0.34
ALOX15 P16050 1/20 0.34
HBB P68871 1/20 0.34
EPHX1 P07099 2/20 0.33
ALDH1A1 P00352 2/20 0.32
MAPK1 P28482 1/20 0.32
TDP1 Q9NUW8 1/20 0.32
CES1 P23141 3/20 0.31
CES2 O00748 2/20 0.31
DAO P14920 1/20 0.31
TSHR P16473 1/20 0.31
NAPRT Q6XQN6 1/20 0.31
EP300 Q09472 1/20 0.31
MCL1 Q07820 1/20 0.31
LMNA P02545 1/20 0.31

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
SCHEMBL3725073 0.81 KDM4E (0.37) AKT1POLBGAAHSD17B10ALDH1A1
SCHEMBL157513 0.80 RAB9A (0.38) POLBGAAHSD17B10HTTMAPT
SCHEMBL9652808 0.78 POLB (0.36) POLBGAAHSD17B10HTTMAPT
SCHEMBL156386 0.75 ALDH1A1 (0.39) POLBGAAHSD17B10HTTMAPT
SCHEMBL9652766 0.75 POLB (0.36) POLBGAAHSD17B10HTTMAPT
SCHEMBL136598 0.74 MAPT (0.41) POLBGAAHSD17B10HTTMAPT
SCHEMBL305024 0.74 ALDH1A1 (0.37) POLBGAAHSD17B10MAPTALDH1A1
SCHEMBL993045 0.73 CES1 (0.45) POLBGAAHSD17B10HTTMAPT
SCHEMBL363122 0.73 MAPT (0.40) POLBGAAHSD17B10HTTMAPT
SCHEMBL156512 0.73 MAPT (0.40) POLBGAAHSD17B10HTTMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5155161-A Living polymer modified by lactam, urea, amino ketone or aldehyde or thio analogs, followed by hydrolysis NIPPON ZEON CO., LTD. (JP) 1992-10-13 US disclosed
EP-0438248-A2 Preparation process of toner NIPPON ZEON CO., LTD. (JP) 1991-07-24 EP disclosed