SCHEMBL5879174

SCHEMBL5879174

O=c1[nH]c(=O)c2c1c1[nH]c3ncccc3c1c1c(=O)[nH]c(=O)c21

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PARP1 P09874 4/20 0.56
AURKA O14965 3/20 0.56
CHEK1 O14757 2/20 0.56
CDK4 P11802 1/20 0.50
CCND1 P24385 1/20 0.50
GABRA1 P14867 1/20 0.48
GABRG2 P18507 1/20 0.48
GABRB3 P28472 1/20 0.48
GABRA5 P31644 1/20 0.48
GABRA3 P34903 1/20 0.48
GABRA2 P47869 1/20 0.48
FEN1 P39748 1/20 0.46
PDK2 Q15119 1/20 0.44
ADORA2A P29274 1/20 0.44
ADORA1 P30542 1/20 0.44
AURKB Q96GD4 1/20 0.41
KMT2A Q03164 1/20 0.41
LOXL3 P58215 1/20 0.41
LOXL2 Q9Y4K0 1/20 0.41
CLK1 P49759 1/20 0.40

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
SCHEMBL5879136 0.88 AURKA (0.49) PARP1AURKACHEK1CDK4CCND1
SCHEMBL22566992 0.74 CDK4 (0.83) PARP1AURKACHEK1CDK4CCND1
SCHEMBL1848649 0.72 PARP1 (0.53) PARP1AURKACDK4CCND1GABRA1
Bis-Imide A SCHEMBL31061368 0.72 CHEK1 (1.00) PARP1CHEK1CDK4CCND1GABRA1
SCHEMBL29406967 0.72 PARP1 (0.67) PARP1AURKAFEN1ADORA2AADORA1
SCHEMBL6531057 0.72 PARP1 (1.00) PARP1AURKAFEN1ADORA2AADORA1
SCHEMBL1441934 0.72 PARP1 (0.67) PARP1AURKAFEN1ADORA2AADORA1
Bis-Imide A SCHEMBL5879127 0.72 CHEK1 (1.00) PARP1CHEK1CDK4CCND1GABRA1
SCHEMBL8803342 0.71 AURKA (0.51) PARP1AURKACDK4CCND1GABRA1
SCHEMBL29368378 0.71 PARP1 (0.56) PARP1AURKACHEK1CDK4CCND1

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
US-7151108-B2 Anticarcinogenic, antiproliferative, and antitumor agents LES LABORATORIES SERVIER (FR) 2006-12-19 US disclosed
EP-1411057-B1 [3,4-a:3,4-c]carbazole derivatives, process for their preparation and pharmaceutical compositions containing them SERVIER LAB (FR) 2005-04-27 EP disclosed
US-20040077672-A1 Anticarcinogenic, antiproliferative, and antitumor agents LES LABORATOIRES SERVIER (FR) 2004-04-22 US disclosed
EP-1411057-A1 [3,4-a:3,4-c]carbazole derivatives, process for their preparation and pharmaceutical compositions containing them Les Laboratoires Servier (FR) 2004-04-21 EP 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-20040077672-A1 Anticarcinogenic, antiproliferative, and antitumor agents XDH, TOP2A, TOP1 PARP1 120/4885AURKA 2868/4885CHEK1 943/4885

“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.