SCHEMBL31473391

SCHEMBL31473391

CN1CCC(N(C)c2ccc(C#N)cn2)CC1

nearest known ligand 0.58

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CCNA2 P20248 1/20 0.58
CDK2 P24941 1/20 0.58
JAK2 O60674 11/20 0.55
JAK3 P52333 10/20 0.55
USP30 Q70CQ3 1/20 0.47
EGLN2 Q96KS0 1/20 0.45
HRH3 Q9Y5N1 1/20 0.43
MEN1 O00255 1/20 0.43
POLB P06746 1/20 0.43
HTT P42858 1/20 0.43
KMT2A Q03164 1/20 0.43
JAK1 P23458 4/20 0.42
NSD2 O96028 1/20 0.42
NMT1 P30419 1/20 0.40
EGLN1 Q9GZT9 1/20 0.40

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
SCHEMBL27297319 1.00 CCNA2 (0.58) CCNA2CDK2JAK2JAK3USP30
SCHEMBL27302585 0.82 JAK2 (0.48) CCNA2CDK2JAK2JAK3USP30
SCHEMBL29119703 0.80 HCRTR2 (0.46) CCNA2CDK2JAK3EGLN2HRH3
SCHEMBL27296079 0.80 CCNA2 (0.47) CCNA2CDK2JAK2JAK3USP30
SCHEMBL31473402 0.80 CCNA2 (0.47) CCNA2CDK2JAK2JAK3USP30
SCHEMBL27308828 0.79 JAK2 (0.48) CCNA2CDK2JAK2JAK3USP30
SCHEMBL3313504 0.78 POLB (0.42) CCNA2CDK2JAK2JAK3USP30
SCHEMBL26124356 0.78 JAK2 (0.50) CCNA2CDK2JAK2JAK3USP30
SCHEMBL26251298 0.78 JAK2 (0.52) JAK2JAK3USP30HRH3MEN1
SCHEMBL27304976 0.77 JAK2 (0.47) CCNA2CDK2JAK2JAK3USP30

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
CN-119866333-A KIT inhibitors, compounds, pharmaceutical compositions, and methods of use thereof 亚力维克希斯股份有限公司 2025-04-22 CN disclosed