SCHEMBL5467770

SCHEMBL5467770

O=c1[nH]c2ccccc2cc1-c1csc(-c2ccccc2Cl)n1

nearest known ligand 0.73

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
CDK5 Q00535 16/20 0.73
CDK5R1 Q15078 16/20 0.73
CYP19A1 P11511 1/20 0.49
CHEK1 O14757 1/20 0.48
KDR P35968 1/20 0.48
LMNA P02545 1/20 0.47
MAPT P10636 1/20 0.47
KMT2A Q03164 1/20 0.47
L3MBTL1 Q9Y468 1/20 0.47
KDM4E B2RXH2 1/20 0.46
NPC1 O15118 1/20 0.46
RAB9A P51151 1/20 0.46
SMN1; SMN2 Q16637 1/20 0.46

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
SCHEMBL5455823 0.91 CDK5 (0.68) CDK5CDK5R1CYP19A1CHEK1KDR
SCHEMBL5469334 0.90 CDK5 (0.70) CDK5CDK5R1CHEK1KDR
SCHEMBL5471078 0.89 CDK5 (0.68) CDK5CDK5R1CHEK1KDRKDM4E
SCHEMBL5464943 0.85 CDK5 (0.67) CDK5CDK5R1CHEK1KDR
SCHEMBL5469022 0.85 CDK5 (0.81) CDK5CDK5R1MAPT
SCHEMBL5463666 0.84 CDK5 (1.00) CDK5CDK5R1KMT2A
SCHEMBL31060607 0.84 CDK5 (1.00) CDK5CDK5R1KMT2A
SCHEMBL5461298 0.83 CDK5 (0.78) CDK5CDK5R1CHEK1MAPT
SCHEMBL5471006 0.83 CDK5 (0.69) CDK5CDK5R1
SCHEMBL5462471 0.82 CDK5 (0.73) CDK5CDK5R1CYP19A1

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 147/4885CYP19A1 368/4885

“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.