SCHEMBL18285362

SCHEMBL18285362

CC(C)c1nccn1-c1cc(C(=O)NC(C)(C)C)cc(-c2ccc(Cl)c(F)c2)c1

nearest known ligand 0.38

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
ANO1 Q5XXA6 1/20 0.38
PDE4A P27815 5/20 0.36
PDE4B Q07343 5/20 0.36
PDE4C Q08493 5/20 0.36
PDE4D Q08499 5/20 0.36
KMO O15229 2/20 0.35
P2RY14 Q15391 1/20 0.35
MAPK14 Q16539 1/20 0.35
POLB P06746 1/20 0.35
APEX1 P27695 1/20 0.35
CNR2 P34972 1/20 0.35
F2 P00734 1/20 0.34
F10 P00742 1/20 0.34
ALOX5AP P20292 2/20 0.34
FEN1 P39748 2/20 0.34
CNR1 P21554 1/20 0.34
KDM4C Q9H3R0 1/20 0.34
HDAC6 Q9UBN7 1/20 0.34
ALPL P05186 1/20 0.33

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
SCHEMBL18285301 0.91 P2RY14 (0.37) ANO1PDE4APDE4BPDE4CPDE4D
SCHEMBL18285340 0.90 KMO (0.36) PDE4APDE4BPDE4CPDE4DKMO
SCHEMBL18285312 0.90 WDR5 (0.38) PDE4APDE4BPDE4CPDE4DP2RY14
SCHEMBL18285360 0.87 P2RY14 (0.40) ANO1PDE4APDE4BPDE4CPDE4D
SCHEMBL18285299 0.87 CNR1 (0.43) ANO1PDE4APDE4BPDE4CPDE4D
SCHEMBL18706194 0.85 P2RY14 (0.37) ANO1PDE4APDE4BPDE4CPDE4D
SCHEMBL18286354 0.84 P2RX3 (0.40) PDE4APDE4BPDE4CPDE4DP2RY14
SCHEMBL18285306 0.83 P2RY14 (0.51) PDE4APDE4BPDE4CPDE4DP2RY14
SCHEMBL18293056 0.80 GRM5 (0.35) PDE4APDE4BPDE4CPDE4DP2RY14
SCHEMBL18285365 0.80 P2RY14 (0.39) PDE4APDE4BPDE4CPDE4DP2RY14

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-107531642-B Imidazole derivatives 豪夫迈·罗氏有限公司 2021-06-22 CN claimed
EP-3303299-B1 IMIDAZOLE DERIVATIVES HOFFMANN LA ROCHE (CH) 2019-04-24 EP claimed
EP-3303299-A1 IMIDAZOLE DERIVATIVES H. Hoffnabb-La Roche Ag (CH) 2018-04-11 EP claimed
WO-2016193235-A1 IMIDAZOLE DERIVATIVES F. HOFFMANN-LA ROCHE AG (CH) 2016-12-08 WO claimed
CN-107531642-B Imidazole derivatives 豪夫迈·罗氏有限公司 2021-06-22 CN disclosed
EP-3303299-B1 IMIDAZOLE DERIVATIVES HOFFMANN LA ROCHE (CH) 2019-04-24 EP disclosed
US-10029989-B2 Imidazole derivatives HOFFMANN-LA ROCHE INC. (US) 2018-07-24 US disclosed
US-10029989-B2 Imidazole derivatives HOFFMANN-LA ROCHE INC. (US) 2018-07-24 US disclosed
US-20180118692-A1 IMIDAZOLE DERIVATIVES HOFFMANN-LA ROCHE INC. (US) 2018-05-03 US disclosed
US-20180118692-A1 IMIDAZOLE DERIVATIVES HOFFMANN-LA ROCHE INC. (US) 2018-05-03 US disclosed
EP-3303299-A1 IMIDAZOLE DERIVATIVES H. Hoffnabb-La Roche Ag (CH) 2018-04-11 EP disclosed
WO-2016193235-A1 IMIDAZOLE DERIVATIVES F. HOFFMANN-LA ROCHE AG (CH) 2016-12-08 WO disclosed
WO-2016193235-A1 IMIDAZOLE DERIVATIVES F. HOFFMANN-LA ROCHE AG (CH) 2016-12-08 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 (2 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-20180118692-A1 IMIDAZOLE DERIVATIVES DRD3, GABRR3, DRD4 ANO1 1134/4885PDE4A 2694/4885PDE4B 3171/4885
US-10029989-B2 Imidazole derivatives DRD3, GABRR3, DRD4 ANO1 1134/4885PDE4A 2694/4885PDE4B 3171/4885

“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.