SCHEMBL30299384

SCHEMBL30299384

CN1CCN(C(=O)C2CCc3ncc(C4(N)N=C(N)NN4)cc3C2)CC1

nearest known ligand 0.33

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
HSD11B1 P28845 1/20 0.33
LMNA P02545 2/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
KMT2A Q03164 1/20 0.32
MKNK1 Q9BUB5 3/20 0.32
HTT P42858 1/20 0.32
WNT1 P04628 1/20 0.32
GSK3B P49841 1/20 0.32
DYRK1A Q13627 1/20 0.32
MAPT P10636 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.32
BTK Q06187 2/20 0.31
KCNH2 Q12809 1/20 0.31
LIMK1 P53667 1/20 0.31
TNK2 Q07912 1/20 0.31
ATM Q13315 1/20 0.31
UBE2N P61088 1/20 0.31

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
SCHEMBL30299359 0.76 CYP2C9 (0.35) LMNAKMT2AMAPTL3MBTL1
SCHEMBL30299382 0.76
SCHEMBL15450782 0.76 HTT (0.42) HSD11B1LMNASMN1; SMN2KMT2AMKNK1
SCHEMBL30299292 0.73 HRH3 (0.32)
SCHEMBL10202552 0.72 LMNA (0.45) HSD11B1LMNASMN1; SMN2KMT2AMKNK1
SCHEMBL13262126 0.72 MAPT (0.40) HSD11B1LMNASMN1; SMN2KMT2AMKNK1
SCHEMBL27790982 0.71 MAPT (0.37) HSD11B1LMNASMN1; SMN2KMT2AMKNK1
SCHEMBL30299333 0.70 MAP3K14 (0.33)
SCHEMBL14853321 0.68 HPGD (0.40) LMNASMN1; SMN2KMT2AHTTMAPT
SCHEMBL30299262 0.65 HRH4 (0.39) MAPTL3MBTL1

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
CN-116075303-A Method of selecting patients treated with a combination of an AXL inhibitor and an immune checkpoint modulator 卑尔根生物股份公司 2023-05-05 CN disclosed
CN-115916344-A AXL inhibitors for antiviral therapy 卑尔根生物股份公司 2023-04-04 CN disclosed