SCHEMBL28679677

SCHEMBL28679677

CC(C)n1cc(-c2nc(Nc3ccc(N4CCN(C)CC4)cc3)ncc2F)nn1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CSF1R P07333 2/20 0.58
▸ CDK2 P24941 3/20 0.52
▸ KCNH2 Q12809 2/20 0.52
▸ EGFR P00533 8/20 0.51
▸ CDK4 P11802 5/20 0.50
▸ CDK6 Q00534 3/20 0.50
▸ CDK1 P06493 2/20 0.50
▸ CCNA2 P20248 2/20 0.50
▸ CCND3 P30281 2/20 0.50
▸ CCND1 P24385 2/20 0.50
▸ CCNB2 O95067 1/20 0.50
▸ CCNE2 O96020 1/20 0.50
▸ FGFR1 P11362 1/20 0.50
▸ CCNB1 P14635 1/20 0.50
▸ FGFR2 P21802 1/20 0.50
▸ FGFR4 P22455 1/20 0.50
▸ FGFR3 P22607 1/20 0.50
▸ CCNE1 P24864 1/20 0.50
▸ CCND2 P30279 1/20 0.50
▸ CCNA1 P78396 1/20 0.50

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
SCHEMBL28714701 0.84 CDK4 (0.62) CSF1RCDK2KCNH2CDK4CDK6
SCHEMBL24664303 0.83 CSF1R (0.63) CSF1RCDK2KCNH2EGFRCDK4
SCHEMBL28717945 0.82 HDAC6 (0.75) CSF1RCDK2KCNH2CDK4CDK6
SCHEMBL28687755 0.82 CDK4 (0.69) CSF1RCDK2EGFRCDK4CDK6
SCHEMBL29370753 0.82 CDK4 (0.69) CSF1RCDK2EGFRCDK4CDK6
SCHEMBL28676599 0.82 CDK2 (0.57) CDK2EGFRCDK4CDK1CCNA2
SCHEMBL29368374 0.81 CDK4 (0.68) CSF1RCDK2EGFRCDK4CDK6
SCHEMBL28689771 0.81 CDK4 (0.68) CSF1RCDK2EGFRCDK4CDK6
SCHEMBL24664372 0.76 CSF1R (0.55) CSF1RCDK2KCNH2CDK4CDK6
SCHEMBL28987265 0.73 CDK4 (0.63) CSF1RCDK2KCNH2EGFRCDK4

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-113999210-B Group of 2-phenylamino-4-triazolyl pyrimidine derivatives and application thereof 郑州大学第一附属医院 2023-05-23 — — CN claimed
CN-113999210-A Group of 2-phenylamino-4-triazolyl pyrimidine derivatives and application thereof 郑州大学第一附属医院 2022-02-01 — — CN claimed
CN-113999210-B Group of 2-phenylamino-4-triazolyl pyrimidine derivatives and application thereof 郑州大学第一附属医院 2023-05-23 — — CN disclosed
CN-113999210-A Group of 2-phenylamino-4-triazolyl pyrimidine derivatives and application thereof 郑州大学第一附属医院 2022-02-01 — — CN disclosed
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