SCHEMBL18806194

SCHEMBL18806194

CC(F)(F)CCN1CCc2nc(C(C)(C)C)ccc2C1

nearest known ligand 0.37

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ ADORA2A P29274 1/20 0.37
▸ CDK4 P11802 2/20 0.35
▸ FLT3 P36888 1/20 0.35
▸ LMNA P02545 3/20 0.35
▸ POLB P06746 1/20 0.35
▸ PDCD1 Q15116 9/20 0.35
▸ CD274 Q9NZQ7 9/20 0.35
▸ MAPT P10636 2/20 0.34
▸ PRMT5 O14744 1/20 0.34
▸ WDR77 Q9BQA1 1/20 0.34
▸ MOGAT2 Q3SYC2 2/20 0.33
▸ TP53 P04637 1/20 0.33
▸ CDK1 P06493 1/20 0.33
▸ CDK2 P24941 1/20 0.33
▸ CDK7 P50613 1/20 0.33
▸ CDK9 P50750 1/20 0.33
▸ CDK6 Q00534 1/20 0.33
▸ CDK5 Q00535 1/20 0.33

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
SCHEMBL18819904 0.92 CDK4 (0.41) ADORA2ACDK4FLT3LMNAPOLB
SCHEMBL20249376 0.84 PDCD1 (0.47) CDK4FLT3LMNAPOLBPDCD1
SCHEMBL18806181 0.82 CDK4 (0.40) CDK4FLT3LMNAPOLBPDCD1
SCHEMBL22966559 0.82 CDK4 (0.42) ADORA2ACDK4LMNAPOLBMAPT
SCHEMBL20255390 0.82 CDK4 (0.43) ADORA2ACDK4LMNAPOLBPDCD1
SCHEMBL20249391 0.82 CDK4 (0.42) CDK4CDK1CDK2CDK7CDK9
SCHEMBL21452407 0.80 POLB (0.39) ADORA2ACDK4LMNAPOLBPDCD1
SCHEMBL18806155 0.80 CDK4 (0.44) ADORA2ACDK4FLT3LMNAPOLB
SCHEMBL20249386 0.77 ADRA1B (0.40) ADORA2APOLBMOGAT2
SCHEMBL20249522 0.76 CD274 (0.45) CDK4PDCD1CD274MAPTCDK2

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
US-9828373-B2 2-amino-pyrido[2,3-D]pyrimidin-7(8H)-one derivatives as CDK inhibitors and uses thereof SUNSHINE LAKE PHARMA CO., LTD. (CN) 2017-11-28 — — US disclosed
US-20170121323-A1 2-AMINO-PYRIDO[2,3-D]PYRIMIDIN-7(8H)-ONE DERIVATIVES AS CDK INHIBITORS AND USES THEREOF SUNSHINE LAKE PHARMA CO., LTD. (CN) 2017-05-04 — — US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20170121323-A1 2-AMINO-PYRIDO[2,3-D]PYRIMIDIN-7(8H)-ONE DERIVATIVES AS CDK INHIBITORS AND USES THEREOF CDK6, CDK4, CDK7 ADORA2A 2170/4885CDK4 2/4885FLT3 825/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.

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