SCHEMBL5744375

SCHEMBL5744375

CON(C)C(=O)c1cccc(OCc2ccncc2)c1

nearest known ligand 0.54

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
SLC2A1 P11166 5/20 0.54
SLC2A4 P14672 1/20 0.54
MAOB P27338 7/20 0.51
KMT2A Q03164 1/20 0.51
GPR132 Q9UNW8 1/20 0.51
NR4A2 P43354 2/20 0.50
SMPD1 P17405 1/20 0.48
MAOA P21397 2/20 0.48
KDM4E B2RXH2 1/20 0.47
CYP1A2 P05177 1/20 0.47
CYP3A4 P08684 1/20 0.47
CYP2D6 P10635 1/20 0.47
CYP2C9 P11712 1/20 0.47
CYP2C19 P33261 1/20 0.47
TLR4 O00206 1/20 0.46
TLR2 O60603 1/20 0.46
NR4A1 P22736 1/20 0.46
NR4A3 Q92570 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
SCHEMBL30678236 0.88 MAOB (0.66) MAOBKMT2ANR4A2SMPD1MAOA
SCHEMBL4200015 0.88 MAOB (0.66) MAOBKMT2ANR4A2SMPD1MAOA
SCHEMBL5866349 0.87 GPR132 (0.59) GPR132
SCHEMBL5605259 0.86 SMPD1 (0.65) MAOBKMT2ANR4A2SMPD1MAOA
SCHEMBL5605085 0.85 MAOB (0.68) MAOBKMT2ANR4A2SMPD1MAOA
SCHEMBL5604959 0.83 SMPD1 (0.63) MAOBKMT2ANR4A2SMPD1MAOA
SCHEMBL7163295 0.82 MRGPRX4 (0.62) SLC2A1SLC2A4MAOBGPR132NR4A2
SCHEMBL5746806 0.81 GPR132 (0.52) MAOBKMT2AGPR132NR4A2KDM4E
SCHEMBL25720168 0.80 LMNA (0.50) KMT2AKDM4E
SCHEMBL7160639 0.80 NR4A2 (0.77) MAOBKMT2AGPR132NR4A2SMPD1

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-7144889-B2 Triarylimidazoles HOFFMAN-LA ROCHE INC. (US) 2006-12-05 US disclosed
EP-1675848-A1 NOVEL TRIARYLIMIDAZOLES F. HOFFMANN-LA ROCHE AG (CH) 2006-07-05 EP disclosed
WO-2005040153-A1 NOVEL TRIARYLIMIDAZOLES F. HOFFMANN-LA ROCHE AG (CH) 2005-05-06 WO disclosed
US-20050085473-A1 Novel triarylimidazoles HOFFMANN-LA ROCHE INC. 2005-04-21 US 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-20050085473-A1 Novel triarylimidazoles AURKAIP1, GLS2, GOT2 SLC2A1 4100/4885SLC2A4 4031/4885MAOB 1708/4885

“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.