SCHEMBL18901129

SCHEMBL18901129

Oc1ccc(C(F)(F)F)cc1NC(=C1CC1)c1ccncc1C(F)(F)F

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.47
KMT2A Q03164 1/20 0.47
P2RX1 P51575 1/20 0.42
TMPRSS4 Q9NRS4 2/20 0.40
CHRNA7 P36544 1/20 0.39
KDM4C Q9H3R0 1/20 0.36
AKT1 P31749 1/20 0.36
KDR P35968 1/20 0.35
SRPK2 P78362 1/20 0.35
SRPK1 Q96SB4 1/20 0.35
SRPK3 Q9UPE1 1/20 0.35
AKR1B1 P15121 1/20 0.35
JAK2 O60674 1/20 0.34
JAK1 P23458 1/20 0.34
TYK2 P29597 1/20 0.34
POLB P06746 1/20 0.34
HTR2A P28223 2/20 0.33
HTR2C P28335 2/20 0.33
KIF11 P52732 1/20 0.33
SNCA P37840 1/20 0.33

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
SCHEMBL1025872 0.83 MEN1 (0.56) MEN1KMT2AP2RX1TMPRSS4CHRNA7
SCHEMBL1024009 0.75 MEN1 (0.55) MEN1KMT2AP2RX1TMPRSS4CHRNA7
SCHEMBL12955661 0.75 MEN1 (0.48) MEN1KMT2AP2RX1TMPRSS4CHRNA7
SCHEMBL1024652 0.74 MEN1 (0.57) MEN1KMT2AP2RX1TMPRSS4CHRNA7
SCHEMBL1025021 0.73 TMPRSS4 (0.57) MEN1KMT2AP2RX1TMPRSS4CHRNA7
SCHEMBL1027417 0.72 TMPRSS4 (0.56) MEN1KMT2AP2RX1TMPRSS4CHRNA7
SCHEMBL1023055 0.72 MEN1 (0.55) MEN1KMT2AP2RX1TMPRSS4CHRNA7
SCHEMBL12774911 0.70 BRAF (0.54) P2RX1TMPRSS4KDRJAK2JAK1
SCHEMBL1023922 0.69 KCNMA1 (0.65) MEN1KMT2ATMPRSS4CHRNA7AKT1
SCHEMBL11993794 0.69 GAA (0.39) MEN1KMT2AKDM4CPOLB

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
EP-2274983-B1 HARMFUL ARTHROPOD CONTROL COMPOSITION, AND FUSED HETEROCYCLIC COMPOUND SUMITOMO CHEMICAL CO (JP) 2017-05-31 EP disclosed