SCHEMBL518282

SCHEMBL518282

Fc1cnc(Cl)nc1-c1c[nH]c2ccccc12

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CDK5 Q00535 2/20 0.49
CDK5R1 Q15078 2/20 0.49
RPS6KA5 O75582 1/20 0.49
CLK1 P49759 1/20 0.49
PIM1 P11309 1/20 0.47
PDGFRB P09619 2/20 0.46
NR4A2 P43354 1/20 0.45
TDO2 P48775 2/20 0.45
MEN1 O00255 5/20 0.45
KMT2A Q03164 5/20 0.45
HTR2C P28335 1/20 0.45
HTR2B P41595 1/20 0.45
HTR5A P47898 1/20 0.45
PDGFRA P16234 1/20 0.45
HTT P42858 1/20 0.44
ALDH1A1 P00352 3/20 0.44
MAPT P10636 2/20 0.44
LMNA P02545 1/20 0.44
CYP1A2 P05177 1/20 0.44
CYP3A4 P08684 1/20 0.44

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
SCHEMBL30957423 1.00 CDK5 (0.49) CDK5CDK5R1RPS6KA5CLK1PIM1
SCHEMBL517461 0.85 RPS6KA5 (0.66) CDK5CDK5R1RPS6KA5CLK1
SCHEMBL29613520 0.85 RPS6KA5 (0.66) CDK5CDK5R1RPS6KA5CLK1
SCHEMBL24900716 0.83 TDO2 (0.51) TDO2
SCHEMBL30957605 0.83 TDO2 (0.51) TDO2
SCHEMBL517438 0.83 JAK2 (0.55) CDK5CDK5R1RPS6KA5CLK1PIM1
SCHEMBL517759 0.83 CCNT1 (0.52) CDK5CDK5R1RPS6KA5CLK1PIM1
SCHEMBL22510124 0.83 CDK5 (0.56) CDK5CDK5R1RPS6KA5CLK1PIM1
SCHEMBL20691183 0.83 CLK1 (0.71) CDK5CDK5R1CLK1PIM1PDGFRB
SCHEMBL23152046 0.83 CLK1 (0.71) CDK5CDK5R1RPS6KA5CLK1PDGFRB

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 12 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20250136576-A1 Heterocyclic Compounds and Uses Thereof ACEA Therapeutics, Inc. (US) 2025-05-01 US disclosed
WO-2023287783-A1 HETEROCYCLIC COMPOUNDS AND USES THEREOF ACEA Therapeutics, Inc. (US) 2023-01-19 WO disclosed
CN-107382974-B Application of pyrimidinamine compound as cyclin-dependent kinase 4/6 inhibitor 扬州市三药制药有限公司 2020-06-05 CN disclosed
EP-2601186-A2 4-(1H-INDOL-3-YL)-PYRIMIDINES AS ALK INHIBITORS AstraZeneca AB (SE) 2013-06-12 EP disclosed
US-8461170-B2 Chemical compounds ASTRAZENECA AB (SE) 2013-06-11 US disclosed
US-8461170-B2 Chemical compounds ASTRAZENECA AB (SE) 2013-06-11 US disclosed
US-8461170-B2 Chemical compounds ASTRAZENECA AB (SE) 2013-06-11 US disclosed
WO-2012017239-A2 CHEMICAL COMPOUNDS ASTRAZENECA AB (SE) 2012-02-09 WO disclosed
WO-2012017239-A2 CHEMICAL COMPOUNDS ASTRAZENECA AB (SE) 2012-02-09 WO disclosed
US-20120028924-A1 CHEMICAL COMPOUNDS ASTRAZENECA AB (SE) 2012-02-02 US disclosed
US-20120028924-A1 CHEMICAL COMPOUNDS ASTRAZENECA AB (SE) 2012-02-02 US disclosed
US-20120028924-A1 CHEMICAL COMPOUNDS ASTRAZENECA AB (SE) 2012-02-02 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 (2 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-20120028924-A1 CHEMICAL COMPOUNDS ALK, BRAF, ABL1 CDK5 195/4885CDK5R1 391/4885RPS6KA5 235/4885
US-20250136576-A1 Heterocyclic Compounds and Uses Thereof CHEK2, CDK2, CDK1 CDK5 22/4885CDK5R1 113/4885RPS6KA5 122/4885

“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.