SCHEMBL31495074

SCHEMBL31495074

O=C(Nc1ccc(Cl)c(C(F)(F)F)c1)C(F)(F)F

nearest known ligand 0.76

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDR P35968 2/20 0.76
PDK1 Q15118 1/20 0.68
CNR2 P34972 1/20 0.61
GRM4 Q14833 1/20 0.59
TRPV1 Q8NER1 4/20 0.58
NPSR1 Q6W5P4 2/20 0.58
MEN1 O00255 2/20 0.58
KMT2A Q03164 2/20 0.58
CA1 P00915 1/20 0.58
CA2 P00918 1/20 0.58
CA7 P43166 1/20 0.58
CA9 Q16790 1/20 0.58
HTT P42858 1/20 0.58
TMPRSS4 Q9NRS4 1/20 0.58
KCNJ5 P48544 1/20 0.58
KCNJ3 P48549 1/20 0.58
SMN1; SMN2 Q16637 1/20 0.57
LMNA P02545 2/20 0.55
HDAC1 Q13547 1/20 0.54
HDAC8 Q9BY41 1/20 0.54

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
SCHEMBL3645017 0.89 KDR (0.73) KDRPDK1CNR2GRM4TRPV1
SCHEMBL1291336 0.87 KDR (0.71) KDRPDK1CNR2GRM4TRPV1
SCHEMBL29625148 0.87 KDR (0.71) KDRPDK1CNR2GRM4TRPV1
SCHEMBL29625146 0.87 KDR (0.71) KDRPDK1CNR2GRM4TRPV1
SCHEMBL118026 0.86 KDR (1.00) KDRPDK1GRM4TRPV1CA1
SCHEMBL29364392 0.86 KDR (1.00) KDRPDK1GRM4TRPV1CA1
SCHEMBL8407112 0.86 KDR (0.69) KDRPDK1CNR2GRM4TRPV1
SCHEMBL8409965 0.86 KDR (0.69) KDRPDK1CNR2GRM4TRPV1
SCHEMBL9835641 0.85 KDR (0.78) KDRPDK1CNR2GRM4TRPV1
SCHEMBL2329430 0.85 KDR (0.78) KDRPDK1CNR2GRM4TRPV1

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-2025037871-A1 TRICYCLIC COMPOUND AND USE THEREOF AS MAT2A INHIBITOR 에스케이바이오팜 주식회사 2025-02-20 WO disclosed