SCHEMBL4817032

SCHEMBL4817032

COc1cc2c(cc1OCc1cccnc1)C(=O)CC2

nearest known ligand 0.60

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
HSD17B10 Q99714 2/20 0.60
KDM4E B2RXH2 1/20 0.60
ALDH1A1 P00352 1/20 0.60
HPGD P15428 1/20 0.60
MAPK1 P28482 1/20 0.60
CHEK1 O14757 3/20 0.52
PDE4D Q08499 2/20 0.49
LMNA P02545 1/20 0.47
CYP19A1 P11511 3/20 0.46
CYP11B1 P15538 3/20 0.45
CYP11B2 P19099 3/20 0.45
BRD4 O60885 1/20 0.45
GPR84 Q9NQS5 1/20 0.44
PDE3A Q14432 1/20 0.44
PDE10A Q9Y233 1/20 0.44
CYP1A2 P05177 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
SCHEMBL4813423 0.85 CHEK1 (0.48) HSD17B10KDM4EALDH1A1HPGDMAPK1
SCHEMBL4814842 0.85 CHRNA7 (0.56) KDM4EGPR84
SCHEMBL3970008 0.85 CHRNA7 (0.56) KDM4EGPR84
SCHEMBL4812829 0.79 MAOA (0.47) ALDH1A1LMNA
SCHEMBL4192600 0.78 MAOB (0.56) ALDH1A1HPGDGPR84
SCHEMBL9621181 0.78 MAOA (0.57) GPR84
SCHEMBL11147426 0.78 MAOA (0.61) GPR84
SCHEMBL5713217 0.78 MAOA (0.61) GPR84
SCHEMBL9620526 0.78 MAOA (0.57) GPR84
SCHEMBL17538299 0.75 LMNA (0.47) HSD17B10KDM4EALDH1A1HPGDMAPK1

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-7320986-B2 Fused tri and tetra-cyclic pyrazole kinase inhibitors ABBOTT LABORTORIES (US) 2008-01-22 US disclosed
EP-1603885-A1 FUSED TRI AND TETRA-CYCLIC PYRAZOLE KINASE INHIBITORS Abbott Laboratories (US) 2005-12-14 EP disclosed
US-20040259904-A1 Fused tri and tetra-cyclic pyrazole kinase inhibitors ABBVIE INC. 2004-12-23 US disclosed
WO-2004080973-A1 FUSED TRI AND TETRA-CYCLIC PYRAZOLE KINASE INHIBITORS ABBOTT LABORATORIES (US) 2004-09-23 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-20040259904-A1 Fused tri and tetra-cyclic pyrazole kinase inhibitors TK1, MAP3K19, MAP3K20 HSD17B10 3236/4885KDM4E 2898/4885ALDH1A1 3848/4885

“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.