SCHEMBL3933866

SCHEMBL3933866

CC(=O)c1cccc(OCBr)c1

nearest known ligand 0.64

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
MAOB P27338 13/20 0.64
MAOA P21397 4/20 0.63
KMT2A Q03164 3/20 0.57
MEN1 O00255 1/20 0.57
SMN1; SMN2 Q16637 1/20 0.56
ABCB1 P08183 2/20 0.50

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
SCHEMBL920108 0.86 MAOB (0.60) MAOBMAOAKMT2AMEN1SMN1; SMN2
SCHEMBL5974513 0.85 MAOB (0.68) MAOBMAOAKMT2AMEN1SMN1; SMN2
SCHEMBL9373361 0.84 MAOB (0.66) MAOBMAOAKMT2AMEN1SMN1; SMN2
SCHEMBL307233 0.84 KMT2A (0.75) MAOBMAOAKMT2AMEN1SMN1; SMN2
SCHEMBL27933717 0.84 NR4A2 (0.65) KMT2A
SCHEMBL27801100 0.83 MRGPRX4 (0.56) KMT2AMEN1SMN1; SMN2
SCHEMBL10799135 0.83 KMT2A (0.51) MAOBMAOAKMT2AMEN1SMN1; SMN2
SCHEMBL8403547 0.82 MAOB (0.64) MAOBMAOAKMT2AMEN1SMN1; SMN2
SCHEMBL7045225 0.82 MAOB (0.64) MAOBMAOAKMT2AMEN1SMN1; SMN2
SCHEMBL27448957 0.82 NR4A2 (0.46) MAOBMAOAKMT2A

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
EP-2044083-A1 ANTIVIRAL AGENTS GENELABS TECHNOLOGIES, INC. (US) 2009-04-08 EP disclosed
US-20080051384-A1 ANTIVIRAL AGENTS GENELABS TECHNOLOGIES, INC. 2008-02-28 US disclosed
WO-2008008912-A1 ANTIVIRAL AGENTS GENELABS TECHNOLOGIES, INC. (US) 2008-01-17 WO disclosed
WO-2008008907-A2 ANTIVIRAL AGENTS GENELABS TECHNOLOGIES, INC. (US) 2008-01-17 WO disclosed
EP-1844042-A1 INDOLE DERIVATIVES FOR TREATING VIRAL INFECTIONS GENELABS TECHNOLOGIES, INC. (US) 2007-10-17 EP disclosed
US-20060211698-A1 Bicyclic heteroaryl derivatives for treating viruses GENELABS, INC. 2006-09-21 US disclosed
WO-2006076529-A1 INDOLE DERIVATIVES FOR TREATING VIRAL INFECTIONS GENELABS TECHNOLOGIES, INC. (US) 2006-07-20 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-20060211698-A1 Bicyclic heteroaryl derivatives for treating viruses HAVCR2, ZC3HAV1, SARS1 MAOB 1216/4885MAOA 1762/4885KMT2A 2460/4885
US-20080051384-A1 ANTIVIRAL AGENTS EIF2AK2, MAVS, ZC3HAV1 MAOB 1059/4885MAOA 1045/4885KMT2A 4254/4885

“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.