SCHEMBL8342129

SCHEMBL8342129

OCCOc1ccccc1N1CCOCC1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 3/20 0.54
MAPT P10636 2/20 0.54
ALDH1A1 P00352 4/20 0.50
GAA P10253 4/20 0.50
PIK3CD O00329 2/20 0.50
PIK3R1 P27986 2/20 0.50
PIK3CA P42336 2/20 0.50
PIK3CB P42338 2/20 0.50
KDM4E B2RXH2 3/20 0.48
AKR1C3 P42330 1/20 0.48
USP2 O75604 1/20 0.47
SMN1; SMN2 Q16637 3/20 0.46
TSHR P16473 1/20 0.46
MCOLN3 Q8TDD5 1/20 0.46
DRD2 P14416 1/20 0.46
DRD3 P35462 1/20 0.46
NPC1 O15118 1/20 0.46
RAB9A P51151 1/20 0.46
KMT2A Q03164 1/20 0.45
NPSR1 Q6W5P4 1/20 0.45

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
SCHEMBL13010487 0.82 AKR1C3 (0.49) POLBMAPTALDH1A1GAAKDM4E
SCHEMBL20630891 0.82 POLB (0.48) POLBMAPTALDH1A1GAAKDM4E
SCHEMBL12528231 0.82 AKR1C3 (0.49) POLBMAPTALDH1A1GAAKDM4E
SCHEMBL7882873 0.81 MAPT (0.52) POLBMAPTALDH1A1GAAAKR1C3
SCHEMBL14320302 0.81 MAPT (0.55) POLBMAPTALDH1A1GAAPIK3CD
Nitrogen SCHEMBL6142719 0.79 DRD2 (0.53) POLBMAPTALDH1A1GAAPIK3CB
SCHEMBL30306325 0.77 HTR1A (0.52) POLBMAPTALDH1A1GAAKDM4E
SCHEMBL2609175 0.77 POLB (0.49) POLBMAPTALDH1A1GAAAKR1C3
SCHEMBL15880500 0.77 POLB (0.49) POLBMAPTALDH1A1GAAKDM4E
SCHEMBL9462161 0.76 ALDH1A1 (0.54) POLBMAPTALDH1A1GAAAKR1C3

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-5958663-A MAGENTA COUPER AND STABILIZER CIBA SPECIALTY CHEMICALS CORPORATION (US) 1999-09-28 US disclosed
US-5763144-A MAGENTA COUPLERS WITH HETEROCYCLIC ESTER STABILIZERS CIBA SPECIALTY CHEMICALS CORPORATION (US) 1998-06-09 US disclosed
WO-1995022082-A1 COLOUR-PHOTOGRAPHIC RECORDING MATERIAL CIBA-GEIGY AG (CH) 1995-08-17 WO disclosed