SCHEMBL28327136

SCHEMBL28327136

CCCOC(=O)C=CC(F)(F)C(F)(F)C(F)(F)C(F)(F)F

nearest known ligand 0.49

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
HCAR2 Q8TDS4 5/20 0.49
ATM Q13315 1/20 0.43
ALOX5 P09917 1/20 0.39
APP P05067 2/20 0.37
HPGD P15428 1/20 0.37
TSHR P16473 1/20 0.37
MAPT P10636 2/20 0.34
RAB9A P51151 1/20 0.34
NPSR1 Q6W5P4 1/20 0.34
THRB P10828 1/20 0.32
KDM4E B2RXH2 1/20 0.30
POLB P06746 1/20 0.30
KMT2A Q03164 1/20 0.30

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
SCHEMBL28327130 0.98 HCAR2 (0.47) HCAR2ATMALOX5APPHPGD
SCHEMBL5004970 0.85 HCAR2 (0.44) HCAR2ATMMAPTNPSR1THRB
SCHEMBL5008509 0.85 HCAR2 (0.44) HCAR2ATMMAPTNPSR1THRB
SCHEMBL5511234 0.85 HCAR2 (0.44) HCAR2ATMMAPTNPSR1THRB
SCHEMBL22231627 0.80 HCAR2 (0.57) HCAR2ATMALOX5APPHPGD
SCHEMBL22231629 0.80 HCAR2 (0.57) HCAR2ATMALOX5APPHPGD
SCHEMBL29126937 0.76 ATM (0.36) HCAR2ATMHPGDTSHRKMT2A
SCHEMBL1886588 0.74 HCAR2 (0.59) HCAR2ATMALOX5APPHPGD
SCHEMBL448454 0.73 HCAR2 (0.82) HCAR2ATMALOX5APPHPGD
SCHEMBL448456 0.73 HCAR2 (0.82) HCAR2ATMALOX5APPHPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-110402260-A Electrophotographic photoreceptor, electrophotographic photoreceptor cartridge, and image forming apparatus MITSUBISHI CHEM CORP 2019-11-01 CN disclosed