SCHEMBL7196887

SCHEMBL7196887

COc1ccc2ccccc2c1CCO

nearest known ligand 0.62

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
MAPT P10636 1/20 0.55
KMT2A Q03164 4/20 0.54
POLB P06746 1/20 0.54
MEN1 O00255 3/20 0.52
SLC6A4 P31645 1/20 0.52
HTT P42858 1/20 0.49
CETP P11597 1/20 0.49

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
SCHEMBL29743344 0.87 SLC6A4 (0.51) MAPTKMT2APOLBMEN1SLC6A4
SCHEMBL29620186 0.86 MAPT (0.58) MAPTKMT2APOLBMEN1HTT
SCHEMBL702988 0.86 MAPT (0.58) MAPTKMT2APOLBMEN1HTT
SCHEMBL28387488 0.84 NCEH1 (0.60) MAPTKMT2APOLBMEN1SLC6A4
SCHEMBL1254856 0.83 SLC6A4 (0.63) MAPTKMT2APOLBMEN1SLC6A4
SCHEMBL5832488 0.83 MAPT (0.55) MAPTKMT2APOLBMEN1SLC6A4
SCHEMBL19766698 0.82 MAPT (0.62) MAPTKMT2APOLBMEN1SLC6A4
Iodide SCHEMBL25290233 0.81 SLC6A4 (0.61) MAPTKMT2APOLBMEN1SLC6A4
Hydrochloric Acid SCHEMBL8709989 0.81 SLC6A4 (0.61) MAPTKMT2APOLBMEN1SLC6A4
SCHEMBL27329722 0.81 NCEH1 (0.62) MAPTKMT2APOLBMEN1SLC6A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6660883-B1 Conversion of aryl alkyl compound such as aryl alkyl alcohols and aryl alkyl halides COUNCIL OF SCIENTIFIC AND INDUSTRIAL RESEARCH (IN) 2003-12-09 US disclosed
US-5817822-A ANTITUOR, ANTIINFLAMMATORY AND ANTIARTHRITIC AGENTS NOVARTIS CORPORATION (US) 1998-10-06 US disclosed