SCHEMBL5458361

SCHEMBL5458361

Cc1nc(-c2nc(-c3cc4ccccc4[nH]c3=O)cs2)cs1

nearest known ligand 0.71

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
CDK5 Q00535 17/20 0.71
CDK5R1 Q15078 17/20 0.71
KDR P35968 2/20 0.47
CHEK1 O14757 1/20 0.47
BRD4 O60885 1/20 0.46
PDGFRB P09619 1/20 0.45
FGFR1 P11362 1/20 0.45

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
SCHEMBL31060607 0.83 CDK5 (1.00) CDK5CDK5R1
SCHEMBL5463666 0.83 CDK5 (1.00) CDK5CDK5R1
SCHEMBL5467770 0.81 CDK5 (0.73) CDK5CDK5R1KDRCHEK1
SCHEMBL5464992 0.81 CDK5 (1.00) CDK5CDK5R1
SCHEMBL5455871 0.80 CDK5 (0.72) CDK5CDK5R1
SCHEMBL5466202 0.80 CDK5 (0.72) CDK5CDK5R1KDRCHEK1
SCHEMBL5463511 0.80 CDK5 (0.72) CDK5CDK5R1KDRCHEK1
SCHEMBL5466138 0.79 CDK5 (1.00) CDK5CDK5R1KDRCHEK1
SCHEMBL5463605 0.79 CDK5 (0.81) CDK5CDK5R1
SCHEMBL5469022 0.79 CDK5 (0.81) CDK5CDK5R1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20070032518-A1 Compounds and methods of use AMGEN INC. (US) 2007-02-08 US disclosed
US-20070032518-A1 Compounds and methods of use AMGEN INC. (US) 2007-02-08 US disclosed
US-20070032518-A1 Compounds and methods of use AMGEN INC. (US) 2007-02-08 US disclosed
EP-1478645-A2 QUINOLINONE DERIVATIVES FOR TREATING CELL PROLIFERATION RELATED DISORDERS Amgen Inc. (US) 2004-11-24 EP disclosed
US-6822097-B1 THIAZOLE-SUBSTITUTED QUINOLINE DERIVATIVES; ANTICARCINOGENIC AGENTS, ANTISTROKE AGENTS; APOPTOSIS AND CELL PROLIFERATION TREATMENT; NERVOUS SYSTEM DISORDERS AMGEN, INC. 2004-11-23 US disclosed
WO-2003066630-A2 QUINOLINONE DERIVATIVES FOR TREATING CELL PROLIFERATION RELATED DISORDERS AMGEN INC. (US) 2003-08-14 WO 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-20070032518-A1 Compounds and methods of use BAX, BAD, CASP3 CDK5 27/4885CDK5R1 147/4885KDR 1651/4885

“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.