SCHEMBL13064065

SCHEMBL13064065

O=Nc1ccccc1COC(=O)NC12CC3CC(CC(C3)C1)C2

nearest known ligand 0.47

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 4/20 0.47
MEN1 O00255 3/20 0.47
EPHX2 P34913 8/20 0.46
FAAH O00519 3/20 0.45
ALDH1A1 P00352 4/20 0.44
MAPK1 P28482 1/20 0.44
KDM4E B2RXH2 2/20 0.44
HPGD P15428 2/20 0.44
HTT P42858 2/20 0.44
LMNA P02545 1/20 0.44
CNR2 P34972 2/20 0.43
CNR1 P21554 1/20 0.43
MAPT P10636 1/20 0.42
TSHR P16473 1/20 0.42
ALOX12 P18054 1/20 0.42
ATM Q13315 1/20 0.42
NPSR1 Q6W5P4 1/20 0.42
HSD17B10 Q99714 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
SCHEMBL13893125 0.81 CYP17A1 (0.52) KMT2AMEN1ALDH1A1MAPK1KDM4E
SCHEMBL6329441 0.78 MEN1 (0.46) KMT2AMEN1EPHX2FAAHALDH1A1
SCHEMBL13590484 0.73 CNR2 (0.57) KMT2AMEN1EPHX2FAAHALDH1A1
SCHEMBL13064257 0.72 EPHX1 (0.65) KMT2AMEN1EPHX2FAAHALDH1A1
SCHEMBL13064256 0.72 EPHX1 (0.65) KMT2AMEN1EPHX2FAAHALDH1A1
SCHEMBL3323134 0.72 KDM4E (0.59) KMT2AMEN1EPHX2FAAHALDH1A1
SCHEMBL11917985 0.72 EPHX1 (0.65) KMT2AMEN1EPHX2FAAHALDH1A1
SCHEMBL16665110 0.71 EPHX2 (0.53) KMT2AMEN1EPHX2FAAHALDH1A1
SCHEMBL1556682 0.70 EPHX2 (0.52) KMT2AMEN1EPHX2FAAHALDH1A1
SCHEMBL1497415 0.70 EPHX2 (0.54) KMT2AMEN1EPHX2FAAHALDH1A1

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-20100304297-A1 PATTERNING PROCESS AND RESIST COMPOSITION SHIN-ETSU CHEMICAL CO., LTD. (JP) 2010-12-02 US disclosed