SCHEMBL8022715

SCHEMBL8022715

CCOC(=O)C1=C(Nc2ccccc2)CCC1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 4/20 0.50
▸ ILK Q13418 1/20 0.50
▸ NPC1 O15118 1/20 0.50
▸ HPGD P15428 1/20 0.50
▸ RAB9A P51151 1/20 0.50
▸ LMNA P02545 1/20 0.49
▸ MAPK1 P28482 1/20 0.49
▸ HSD17B10 Q99714 1/20 0.49
▸ TLR2 O60603 4/20 0.48
▸ ACHE P22303 2/20 0.47
▸ DHODH Q02127 1/20 0.47
▸ ATM Q13315 1/20 0.47
▸ SMN1; SMN2 Q16637 3/20 0.45
▸ ALDH1A1 P00352 1/20 0.45
▸ GAA P10253 2/20 0.44
▸ MEN1 O00255 1/20 0.44
▸ NPY1R P25929 1/20 0.44
▸ NPY2R P49146 1/20 0.44
▸ KMT2A Q03164 1/20 0.44
▸ NPSR1 Q6W5P4 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
SCHEMBL10803715 0.97 MAPT (0.50) MAPTILKNPC1HPGDRAB9A
SCHEMBL17040938 0.84 MAPT (0.54) MAPTILKNPC1HPGDRAB9A
SCHEMBL3911808 0.84 MAPT (0.52) MAPTILKNPC1HPGDRAB9A
SCHEMBL12285436 0.82 ALDH1A1 (0.52) MAPTHPGDLMNAACHEDHODH
SCHEMBL2312071 0.81 SMN1; SMN2 (0.51) MAPTNPC1HPGDRAB9AHSD17B10
SCHEMBL3909913 0.80 MAPT (0.49) MAPTILKNPC1HPGDRAB9A
SCHEMBL10565678 0.79 NAMPT (0.40) MAPTILKNPC1HPGDRAB9A
SCHEMBL30782219 0.79 ALOX5 (0.50) LMNATLR2ALDH1A1MEN1NPY2R
SCHEMBL4492930 0.79 MAPT (0.43) MAPTHPGDRAB9ALMNAMAPK1
SCHEMBL14571459 0.78 SMN1; SMN2 (0.57) MAPTNPC1HPGDRAB9ALMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0214009-A2 Enaminones as potential prodrugs of primary and secondary amines MERCK & CO. INC. (US) 1987-03-11 — — EP claimed
US-6130228-A Polycyclic compounds UNIVERSITY OF STRATHCLYDE (GB) 2000-10-10 — — US disclosed
EP-0877735-A1 POLYCYCLIC COMPOUNDS University of Strathclyde (GB) 1998-11-18 — — EP disclosed
WO-1997019929-A1 POLYCYCLIC COMPOUNDS THE UNIVERSITY OF STRATHCLYDE (GB) 1997-06-05 — — WO disclosed
EP-0214009-A2 Enaminones as potential prodrugs of primary and secondary amines MERCK & CO. INC. (US) 1987-03-11 — — EP disclosed
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