SCHEMBL24318148

SCHEMBL24318148

C=N/C(=C\C)N1CCOCC1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.40
CA12 O43570 3/20 0.37
CA1 P00915 3/20 0.37
CA9 Q16790 3/20 0.37
CA2 P00918 2/20 0.37
LMNA P02545 1/20 0.36
ALDH1A1 P00352 2/20 0.35
MGLL Q99685 2/20 0.35
FAAH O00519 1/20 0.35
PHGDH O43175 1/20 0.35
ALDH2 P05091 1/20 0.35
PDK1 Q15118 1/20 0.35
PDK2 Q15119 1/20 0.35
PDK3 Q15120 1/20 0.35
MAPT P10636 2/20 0.35
MEN1 O00255 1/20 0.34
TP53 P04637 1/20 0.34
KMT2A Q03164 1/20 0.34
HTT P42858 1/20 0.34
TSHR P16473 1/20 0.34

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
SCHEMBL24497941 0.80 MAPT (0.37) SMN1; SMN2CA12CA1CA9CA2
SCHEMBL19494263 0.80 HTT (0.38) SMN1; SMN2CA12CA1CA9CA2
SCHEMBL19286446 0.77 LMNA (0.38) SMN1; SMN2CA12CA1CA9CA2
SCHEMBL19566668 0.76 SMN1; SMN2 (0.36) SMN1; SMN2LMNAALDH1A1MGLLFAAH
SCHEMBL18745776 0.75 SMN1; SMN2 (0.35) SMN1; SMN2ALDH1A1MGLLFAAHPHGDH
SCHEMBL18744925 0.74 SMN1; SMN2 (0.42) SMN1; SMN2CA12CA1CA9ALDH1A1
SCHEMBL22569392 0.74 LMNA (0.35) SMN1; SMN2LMNA
SCHEMBL24070337 0.70 CA12 (0.41) SMN1; SMN2CA12CA1CA9CA2
SCHEMBL22135147 0.70 SMN1; SMN2 (0.44) SMN1; SMN2CA12CA1CA9CA2
SCHEMBL19016204 0.70 SMN1; SMN2 (0.44) SMN1; SMN2CA12CA1CA9CA2

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-2022081469-A1 INHIBITORS OF RAF KINASES KINNATE BIOPHARMA INC. (US) 2022-04-21 WO disclosed