SCHEMBL29035529

SCHEMBL29035529

NC1CCNCC1.O=C(O)c1n[nH]cc1NC(=O)c1c(Cl)cccc1Cl

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CDK14 O94921 11/20 0.51
CCNY Q8ND76 11/20 0.51
CDK2 P24941 6/20 0.51
CCNA2 P20248 4/20 0.51
CDK5 Q00535 3/20 0.51
CDK9 P50750 3/20 0.51
CCNA1 P78396 3/20 0.51
CDK1 P06493 3/20 0.51
CCNB1 P14635 3/20 0.51
CCNT1 O60563 2/20 0.51
CDK5R1 Q15078 2/20 0.51
CDK4 P11802 2/20 0.51
CASK O14936 1/20 0.51
CDKL5 O76039 1/20 0.51
CCNB2 O95067 1/20 0.51
MAK P20794 1/20 0.51
CDK11B P21127 1/20 0.51
CCND1 P24385 1/20 0.51
CCNE1 P24864 1/20 0.51
CCND3 P30281 1/20 0.51

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
SCHEMBL954955 0.86 KMT2A (0.51) CDK14CCNYCDK2CCNA2CDK5
At-7519 SCHEMBL955568 0.83 CDK5 (0.67) CDK14CCNYCDK2CCNA2CDK5
SCHEMBL4488401 0.82 CDK14 (0.48) CDK14CCNYCDK2CCNA2CDK5
At-7519 SCHEMBL953647 0.82 CDK5 (0.66) CDK14CCNYCDK2CCNA2CDK5
At-7519 SCHEMBL31046986 0.82 CDK5 (0.66) CDK14CCNYCDK2CCNA2CDK5
At-7519 SCHEMBL1069453 0.81 CDK5 (0.62) CDK14CCNYCDK2CCNA2CDK5
SCHEMBL29035532 0.81 CDK2 (0.47) CDK14CCNYCDK2CCNA2CDK5
SCHEMBL8219606 0.81 TYK2 (0.52) CDK14CCNYMEN1KMT2ATYK2
SCHEMBL8261519 0.79 CDK5 (0.49) CDK14CCNYCDK2CCNA2CDK5
SCHEMBL1645592 0.78 JAK2 (0.52) CDK14CCNYCDK2CCNA2MEN1

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-109705090-B Tartaric acid addition salts of 3, 4-disubstituted 1H-pyrazole compounds and crystalline forms thereof 上海君实生物医药科技股份有限公司 2023-06-20 CN claimed