SCHEMBL30299337

SCHEMBL30299337

CN(C)[C@@H]1CCN(c2ccc(C3(N)N=C(N)NN3)cc2F)C1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FPR1 P21462 2/20 0.37
FPR2 P25090 2/20 0.37
LCK P06239 2/20 0.35
KDR P35968 2/20 0.35
TEK Q02763 2/20 0.35
PIM1 P11309 1/20 0.35
PIM3 Q86V86 1/20 0.35
PIM2 Q9P1W9 1/20 0.35
MAP4K4 O95819 1/20 0.34
PIK3CD O00329 3/20 0.33
CSF1R P07333 3/20 0.33
CDK4 P11802 3/20 0.33
CDK6 Q00534 3/20 0.33
LRRK2 Q5S007 2/20 0.33
JAK2 O60674 1/20 0.33
CCNK O75909 1/20 0.32
CCNA2 P20248 1/20 0.32
CDK2 P24941 1/20 0.32
CDK7 P50613 1/20 0.32
CDK9 P50750 1/20 0.32

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
SCHEMBL30090537 0.94 TNIK (0.36) FPR1FPR2LCKKDRTEK
SCHEMBL29928562 0.89 CDK4 (0.31) CDK4JAK2CDK2
SCHEMBL30299336 0.87 JAK2 (0.35) PIK3CDCSF1RCDK4CDK6JAK2
SCHEMBL30299330 0.85 GAA (0.34)
SCHEMBL30299352 0.83 HTR1D (0.35)
SCHEMBL30299377 0.83 PDE3B (0.34) PIM1HRH3
SCHEMBL30299381 0.82 IP6K1 (0.32)
SCHEMBL30299371 0.79 ALDH1A1 (0.43) HRH4
SCHEMBL30299387 0.79 OPRM1 (0.31) PIM1
SCHEMBL29929683 0.79 AXL (0.40) CSF1RCDK4CDK6HRH3

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