SCHEMBL29608206

SCHEMBL29608206

CCCN1CCC(n2cc(-c3nc(Cl)ncc3F)cn2)CC1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ FGFR1 P11362 8/20 0.41
▸ FGFR2 P21802 8/20 0.41
▸ FGFR3 P22607 8/20 0.41
▸ MYLK4 Q86YV6 1/20 0.39
▸ STK17A Q9UEE5 1/20 0.39
▸ DYRK1A Q13627 3/20 0.38
▸ GSK3B P49841 2/20 0.38
▸ EGFR P00533 1/20 0.37
▸ CDK2 P24941 3/20 0.37
▸ CDK1 P06493 2/20 0.37
▸ CCNB1 P14635 2/20 0.37
▸ CCNE1 P24864 2/20 0.37
▸ CCNB2 O95067 1/20 0.37
▸ CCNE2 O96020 1/20 0.37
▸ CDK5 Q00535 1/20 0.37
▸ CDK5R1 Q15078 1/20 0.37
▸ CCNB3 Q8WWL7 1/20 0.37
▸ MET P08581 2/20 0.37
▸ CDK4 P11802 2/20 0.36
▸ CDK6 Q00534 2/20 0.36

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
SCHEMBL24664466 1.00 FGFR1 (0.41) FGFR1FGFR2FGFR3MYLK4STK17A
SCHEMBL30919959 0.77 KIT (0.42) CDK2CDK1CCNB1CCNE1
SCHEMBL29607254 0.76 KDM5B (0.41) CDK2CDK1CCNB1CCNE1CCNB2
SCHEMBL22852543 0.76 KDM5B (0.41) CDK2CDK1CCNB1CCNE1CCNB2
SCHEMBL24663775 0.76 MYLK4 (0.50) MYLK4STK17AEGFRCDK2CDK1
SCHEMBL24301059 0.76 CCNC (0.49) FGFR1FGFR2FGFR3EGFRMET
SCHEMBL29528376 0.76 CCNC (0.49) FGFR1FGFR2FGFR3EGFRMET
SCHEMBL30926322 0.76 CDK1 (0.47) FGFR1FGFR2FGFR3DYRK1AGSK3B
SCHEMBL24663778 0.74 FLT3 (0.53) MYLK4STK17ACDK2CDK4CDK6
SCHEMBL17059212 0.74 CCNE2 (0.49) FGFR3CDK2CDK1CCNB1CCNE1

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-114423750-B 2, 4-Disubstituted pyrimidine derivative, preparation method and application thereof 成都赜灵生物医药科技有限公司 2024-04-19 — — CN disclosed
CN-114423750-A 2, 4-disubstituted pyrimidine derivative and preparation method and application thereof 成都赜灵生物医药科技有限公司 2022-04-29 — — CN disclosed
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