SCHEMBL29928562

SCHEMBL29928562

CCN(CC)C1CCN(c2ccc(C3(N)N=C(N)NN3)cc2F)C1

nearest known ligand 0.31

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
CDK4 P11802 2/20 0.31
CCND1 P24385 2/20 0.31
CDK2 P24941 2/20 0.31
GAA P10253 2/20 0.31
WDR5 P61964 1/20 0.31
PIK3CA P42336 1/20 0.30
MTOR P42345 1/20 0.30
HPGD P15428 1/20 0.30
SMN1; SMN2 Q16637 1/20 0.30
JAK2 O60674 1/20 0.30

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
SCHEMBL30299330 0.94 GAA (0.34) GAAHPGDSMN1; SMN2
SCHEMBL30299337 0.89 FPR1 (0.37) CDK4CDK2JAK2
SCHEMBL30299352 0.86 HTR1D (0.35) GAAHPGDSMN1; SMN2
SCHEMBL30090537 0.85 TNIK (0.36) CDK4CDK2GAAJAK2
SCHEMBL30299336 0.82 JAK2 (0.35) CDK4CDK2GAAHPGDSMN1; SMN2
SCHEMBL30299403 0.80 MAP4K4 (0.34) CDK4CCND1CDK2JAK2
SCHEMBL30299377 0.80 PDE3B (0.34) GAAHPGDSMN1; SMN2
SCHEMBL30299381 0.80 IP6K1 (0.32)
SCHEMBL30299387 0.79 OPRM1 (0.31)
SCHEMBL30299371 0.77 ALDH1A1 (0.43) GAAWDR5

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-110551105-B Substituted triazoles useful as AXL inhibitors 里格尔制药公司 2022-10-18 CN claimed
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
CN-110551105-B Substituted triazoles useful as AXL inhibitors 里格尔制药公司 2022-10-18 CN disclosed