SCHEMBL5849720

SCHEMBL5849720

Cc1ccc(C)c(Cn2ccnc2)c1

nearest known ligand 0.66

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
CYP11B1 P15538 7/20 0.66
CYP11B2 P19099 6/20 0.66
CYP19A1 P11511 6/20 0.60
POLB P06746 1/20 0.55
CTDSP1 Q9GZU7 1/20 0.55
TDP1 Q9NUW8 1/20 0.55
TSHR P16473 1/20 0.51
TBXAS1 P24557 1/20 0.49
ATM Q13315 1/20 0.49
KDM4E B2RXH2 1/20 0.48
HSD17B10 Q99714 1/20 0.48
KMT2A Q03164 1/20 0.47

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
SCHEMBL10945622 0.84 CYP11B1 (0.57) CYP11B1CYP11B2CYP19A1POLBCTDSP1
SCHEMBL4290436 0.84 CYP11B1 (0.62) CYP11B1CYP11B2CYP19A1POLBKDM4E
SCHEMBL17679983 0.81 TSHR (0.60) POLBCTDSP1TDP1TSHRKDM4E
SCHEMBL1509681 0.79 CYP11B1 (1.00) CYP11B1CYP11B2CYP19A1POLBTBXAS1
SCHEMBL23961241 0.78 CYP11B1 (0.68) CYP11B1CYP11B2CYP19A1POLBTBXAS1
Iodide SCHEMBL28192688 0.78 CYP11B1 (0.97) CYP11B1CYP11B2CYP19A1POLBTBXAS1
Hydrochloric Acid SCHEMBL28135987 0.78 CYP11B1 (0.97) CYP11B1CYP11B2CYP19A1POLBTBXAS1
SCHEMBL28177559 0.77 POLB (0.47) CYP11B1CYP11B2POLBTSHRKDM4E
SCHEMBL26613644 0.76 CYP11B1 (0.69) CYP11B1CYP11B2CYP19A1POLBTBXAS1
SCHEMBL13105206 0.76 CYP11B1 (0.58) CYP11B1CYP11B2CYP19A1POLBTBXAS1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-62187403-A None JP disclosed
US-6984646-B2 Imidazopyridinones as p38 map kinase inhibitors BAYER HEALHCARE AG (DE) 2006-01-10 US disclosed
EP-1412353-B1 IMIDAZOPYRIDINONES AS P38 MAP KINASE INHIBITORS BAYER HEALTHCARE AG (DE) 2005-03-02 EP disclosed
US-20040220208-A1 Imidazopyridinones as p38 map kinase inhibitors BAYER HEALTHCARE AG (DE) 2004-11-04 US disclosed
EP-1412353-A1 IMIDAZOPYRIDINONES AS P38 MAP KINASE INHIBITORS Bayer HealthCare AG (DE) 2004-04-28 EP disclosed
WO-2003008413-A1 IMIDAZOPYRIDINONES AS P38 MAP KINASE INHIBITORS BAYER HEALTHCARE AG (DE) 2003-01-30 WO disclosed
JP-S62187403-A PLANT-GROWTH REGULATOR RIKAGAKU KENKYUSHO 1987-08-15 JP 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-20040220208-A1 Imidazopyridinones as p38 map kinase inhibitors MAPK1, MAPK3, MAP3K1 CYP11B1 245/4885CYP11B2 292/4885CYP19A1 2272/4885

“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.