SCHEMBL20096909

SCHEMBL20096909

Cc1ccc2c(c1)c1ccc(C(F)(F)F)cc1n2C

nearest known ligand 0.69

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KIF11 P52732 4/20 0.69
BCHE P06276 1/20 0.44
ACHE P22303 1/20 0.44
TP53 P04637 1/20 0.41
MAPT P10636 3/20 0.40
KDM4E B2RXH2 2/20 0.40
APAF1 O14727 1/20 0.40
PKM P14618 1/20 0.40
IDO1 P14902 1/20 0.40
MAPK1 P28482 1/20 0.40
HTT P42858 1/20 0.40
RAB9A P51151 1/20 0.40
MCL1 Q07820 1/20 0.40
NPSR1 Q6W5P4 1/20 0.40
TDP1 Q9NUW8 1/20 0.40
RORA P35398 1/20 0.40
RORC P51449 1/20 0.40
RORB Q92753 1/20 0.40
HTR6 P50406 2/20 0.39
HRH1 P35367 1/20 0.39

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
SCHEMBL12354899 0.92 KIF11 (0.57) KIF11BCHEACHETP53MAPT
SCHEMBL21454581 0.86 KIF11 (0.82) KIF11MAPTKDM4EPKMRORC
SCHEMBL13564051 0.86 KIF11 (0.51) KIF11BCHEACHETP53MAPT
SCHEMBL13564053 0.84 KIF11 (0.59) KIF11TP53MAPTKDM4EAPAF1
SCHEMBL20466817 0.82 BCHE (0.54) KIF11BCHEACHEMAPTKDM4E
SCHEMBL13383054 0.82 KIF11 (0.65) KIF11MAPTKDM4EPKMHTT
SCHEMBL21454578 0.81 KIF11 (1.00) KIF11MAPTKDM4EHTTRAB9A
SCHEMBL21311348 0.80 ALDH1A1 (0.46) KIF11TP53RORARORCRORB
SCHEMBL25490702 0.80 KIF11 (0.46) KIF11BCHEACHEMAPTKDM4E
SCHEMBL20096916 0.80 KIF11 (0.49) KIF11BCHEACHEMAPTKDM4E

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
WO-2018075947-A1 METHODS AND COMPOSITIONS FOR THE TREATMENT OF RNA VIRAL INFECTIONS THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2018-04-26 WO disclosed