SCHEMBL2138659

SCHEMBL2138659

OOC1c2ccccc2-c2ccccc21

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.43
GPR3 P46089 2/20 0.41
HTR2A P28223 1/20 0.41
HDAC3 O15379 1/20 0.40
HDAC4 P56524 1/20 0.40
HDAC7 Q8WUI4 1/20 0.40
HDAC8 Q9BY41 1/20 0.40
HDAC6 Q9UBN7 1/20 0.40
HDAC9 Q9UKV0 1/20 0.40
HDAC5 Q9UQL6 1/20 0.40
NCOR2 Q9Y618 1/20 0.40
ACHE P22303 3/20 0.36
BCHE P06276 2/20 0.36
KMT2A Q03164 2/20 0.35
CA1 P00915 1/20 0.35
CA2 P00918 1/20 0.35
MEN1 O00255 1/20 0.35
CYP1A2 P05177 2/20 0.34
CYP2D6 P10635 1/20 0.34
TSHR P16473 1/20 0.34

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
SCHEMBL13327258 0.78 GPR3 (0.44) POLBGPR3HTR2AHDAC3HDAC4
SCHEMBL29090326 0.74 GPR3 (0.41) POLBGPR3HTR2AHDAC3HDAC4
SCHEMBL5473773 0.74 HTR2A (0.46) POLBGPR3HTR2AHDAC3HDAC4
SCHEMBL10518378 0.74 GPR3 (0.46) POLBGPR3HTR2AHDAC3HDAC4
SCHEMBL28549475 0.73 POLB (0.39) POLBGPR3HTR2AHDAC3HDAC4
SCHEMBL5556649 0.73 POLB (0.39) POLBGPR3HTR2AHDAC3HDAC4
SCHEMBL11574618 0.73 HTR2A (0.52) HTR2AHDAC4HDAC7HDAC5DRD3
SCHEMBL7596802 0.72 POLB (0.52) POLBHDAC3HDAC4HDAC7HDAC8
SCHEMBL20917779 0.72 POLB (0.52) POLBGPR3HTR2AHDAC3HDAC4
SCHEMBL931810 0.70 POLB (0.50) POLBHDAC3HDAC4HDAC7HDAC8

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9656257-B2 Metal oxide supported palladium catalyst for hydrocarbon oxidation UMM AL-QURA UNIVERSITY (SA) 2017-05-23 US disclosed
EP-2246377-B1 RESIN COMPOSITION ASAHI KASEI E MATERIALS CORP (JP) 2014-08-27 EP disclosed
CN-101945905-B Resin composition ASAHI KASEI E MATERIALS CORP 2013-06-26 CN disclosed
US-20110048261-A1 RESIN COMPOSITION ASAHI KASEI E-MATERIALS CORPORATION (JP) 2011-03-03 US disclosed
CN-101945905-A Resin composition ASAHI KASEI E MATERIALS CORP 2011-01-12 CN disclosed
EP-2246377-A1 RESIN COMPOSITION Asahi Kasei E-materials Corporation (JP) 2010-11-03 EP disclosed
EP-0453021-A1 Process for preparing a cycloalkanone and/or cycloalkanol DSM N.V. (NL) 1991-10-23 EP disclosed