SCHEMBL5490486

SCHEMBL5490486

Cc1c(NC(=O)c2ccccc2)cccc1C(F)(F)F

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TAS2R14 Q9NYV8 1/20 0.59
POLB P06746 3/20 0.57
HPGD P15428 1/20 0.57
GAA P10253 1/20 0.55
KCNK3 O14649 1/20 0.55
KCNK9 Q9NPC2 1/20 0.55
HDAC1 Q13547 1/20 0.55
HDAC8 Q9BY41 1/20 0.55
HDAC6 Q9UBN7 1/20 0.55
MDM4 O15151 1/20 0.53
TP53 P04637 1/20 0.53
MAPT P10636 3/20 0.53
MEN1 O00255 1/20 0.52
KMT2A Q03164 1/20 0.52
NPC1 O15118 1/20 0.52
RAB9A P51151 1/20 0.52
SMN1; SMN2 Q16637 1/20 0.52
ALDH1A1 P00352 3/20 0.51
ALOX12 P18054 2/20 0.51
LMNA P02545 1/20 0.51

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
SCHEMBL6170575 0.85 POLB (0.67) POLBHPGDGAAKCNK3KCNK9
SCHEMBL30008296 0.85 POLB (0.67) POLBHPGDGAAKCNK3KCNK9
SCHEMBL11067319 0.85 TAS2R14 (0.63) TAS2R14POLBHPGDGAAHDAC6
SCHEMBL19976979 0.84 TAS2R14 (0.50) TAS2R14POLBKCNK3KCNK9HDAC1
SCHEMBL6054990 0.84 ALDH1A1 (0.59) HDAC1TP53MAPTMEN1KMT2A
SCHEMBL16330055 0.84 POLB (0.72) POLBHPGDHDAC1MDM4TP53
SCHEMBL28169922 0.82 SMN1; SMN2 (0.59) POLBHPGDGAAKCNK3KCNK9
SCHEMBL28316791 0.82 POLB (0.57) POLBHPGDGAAHDAC1MDM4
SCHEMBL23167346 0.81 TAS2R14 (0.58) TAS2R14POLBHPGDGAAHDAC6
SCHEMBL30152395 0.81 TAS2R14 (0.58) TAS2R14POLBHPGDGAAHDAC6

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
EP-1836174-A2 ARYL NITROGEN-CONTAINING BICYCLIC COMPOUNDS AND THEIR USE AS KINASE INHIBITORS AMGEN INC. (US) 2007-09-26 EP claimed
WO-2006039718-A2 ARYL NITROGEN-CONTAINING BICYCLIC COMPOUNDS AND THEIR USE AS KINASE INHIBITORS AMGEN INC (US) 2006-04-13 WO claimed