SCHEMBL7385960

SCHEMBL7385960

CCOC(=O)C1CCOc2c(cccc2N2CCCC2)C1=O

nearest known ligand 0.43

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MAPT P10636 5/20 0.43
ALDH1A1 P00352 4/20 0.43
MEN1 O00255 4/20 0.43
KMT2A Q03164 4/20 0.43
HPGD P15428 2/20 0.43
KDM4E B2RXH2 2/20 0.43
HSD17B10 Q99714 2/20 0.43
GAA P10253 1/20 0.43
MAPK1 P28482 1/20 0.38
ATM Q13315 1/20 0.38
LGMN Q99538 2/20 0.37
TDP1 Q9NUW8 1/20 0.36
POLB P06746 1/20 0.36
GABRA1 P14867 1/20 0.36
GABRG2 P18507 1/20 0.36
GABRB3 P28472 1/20 0.36
GABRA5 P31644 1/20 0.36
GABRA3 P34903 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36

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
SCHEMBL7387427 0.83 ALDH1A1 (0.46) MAPTALDH1A1MEN1KMT2AHPGD
SCHEMBL7703383 0.82 ALDH1A1 (0.45) MAPTALDH1A1MEN1KMT2AHPGD
SCHEMBL7381743 0.81 ALDH1A1 (0.44) MAPTALDH1A1MEN1KMT2AHPGD
SCHEMBL7537264 0.81 ALDH1A1 (0.44) MAPTALDH1A1MEN1KMT2AHPGD
SCHEMBL7376997 0.80 RAB9A (0.44) MAPTALDH1A1MEN1KMT2AHPGD
SCHEMBL7701186 0.79 ALDH1A1 (0.42) MAPTALDH1A1MEN1KMT2AHPGD
SCHEMBL7378114 0.79 ALDH1A1 (0.42) MAPTALDH1A1MEN1KMT2AHPGD
SCHEMBL7381343 0.77 TRPV1 (0.40) MAPTALDH1A1MEN1KMT2AHPGD
SCHEMBL4243033 0.76 ALDH1A1 (0.48) MAPTALDH1A1MEN1KMT2AHPGD
SCHEMBL14408833 0.72 MEN1 (0.48) MAPTALDH1A1MEN1KMT2AHPGD

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
WO-1998055475-A1 GUANIDINE DERIVIATIVES AS INHIBITORS OF NA+/H+ EXCHANGE IN CELLS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1998-12-10 WO disclosed