SCHEMBL7299079

SCHEMBL7299079

Cc1ccc2c(c1)OCC[CH]2

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.42
ALDH1A1 P00352 1/20 0.42
GAA P10253 1/20 0.42
HSD17B10 Q99714 1/20 0.42
LMNA P02545 2/20 0.35
SMN1; SMN2 Q16637 2/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
NPC1 O15118 6/20 0.33
RAB9A P51151 6/20 0.33
PIK3CA P42336 1/20 0.33
PIK3CB P42338 1/20 0.33
PIK3CG P48736 1/20 0.33
CTNNB1 P35222 1/20 0.33
WNT3A P56704 1/20 0.33
MMP12 P39900 1/20 0.33
CA12 O43570 1/20 0.32
CA9 Q16790 1/20 0.32
CYP19A1 P11511 1/20 0.32
KMT2A Q03164 2/20 0.31
ADRA2A P08913 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
SCHEMBL9584121 0.84 MAPT (0.46) MAPTALDH1A1GAAHSD17B10LMNA
SCHEMBL7298125 0.76 MAP3K14 (0.43) MAPTNPC1RAB9A
SCHEMBL7291256 0.76 MAPT (0.50) MAPTGAALMNAL3MBTL1NPC1
SCHEMBL7292136 0.76 FABP6 (0.38) MAPTALDH1A1GAALMNASMN1; SMN2
SCHEMBL14626669 0.73 MAPT (0.40) MAPTALDH1A1GAAHSD17B10LMNA
SCHEMBL3844432 0.72 MAPT (0.35) MAPTALDH1A1HSD17B10LMNANPC1
SCHEMBL11905 0.72 MAPT (0.53) MAPTALDH1A1GAAHSD17B10LMNA
SCHEMBL131072 0.70 ITGB2 (0.52) MAPTGAALMNASMN1; SMN2KMT2A
SCHEMBL3534932 0.68 MAOB (0.40) ALDH1A1SMN1; SMN2NPC1RAB9AHPGD
SCHEMBL29636337 0.68 ALDH1A1 (0.50) MAPTALDH1A1GAAHSD17B10LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5260444-A Cardiovascular, hypotensive WAKUNAGA SEIYAKU KABUSHIKI KAISHA (JP) 1993-11-09 US disclosed
US-5208245-A Hypotensive agents WAKUNAGA SEIYAKU KABUSHIKI KAISHA (JP) 1993-05-04 US disclosed
EP-0460418-A2 Novel Dihydropyridine derivative WAKUNAGA SEIYAKU KABUSHIKI KAISHA (JP) 1991-12-11 EP disclosed