SCHEMBL5279148

SCHEMBL5279148

NC(=O)COCc1ccc(F)cc1

nearest known ligand 0.57

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ MAOB P27338 6/20 0.51
▸ PARP10 Q53GL7 1/20 0.51
▸ IDO1 P14902 3/20 0.50
▸ AGXT P21549 2/20 0.50
▸ NR4A2 P43354 2/20 0.45
▸ GRM5 P41594 1/20 0.44
▸ KCNH2 Q12809 1/20 0.42
▸ KDM4E B2RXH2 1/20 0.42
▸ MEN1 O00255 1/20 0.41
▸ ALDH1A1 P00352 1/20 0.41
▸ KMT2A Q03164 1/20 0.41

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
SCHEMBL360819 0.82 NR4A2 (0.50) MAOBPARP10IDO1AGXTNR4A2
SCHEMBL21664684 0.81 RAB9A (0.54) MAOBPARP10AGXTKCNH2ALDH1A1
SCHEMBL6038136 0.81 IDO1 (0.45) MAOBPARP10IDO1AGXTNR4A2
SCHEMBL5282539 0.81 IDO1 (0.45) MAOBPARP10IDO1AGXTNR4A2
SCHEMBL16542339 0.81 RXRA (0.45) IDO1ALDH1A1
SCHEMBL203767 0.80 TSHR (0.56) PARP10IDO1GRM5KDM4EALDH1A1
Hydroxyamine SCHEMBL8923579 0.79 IDO1 (0.62) MAOBPARP10IDO1AGXTNR4A2
SCHEMBL4432738 0.79 MAOB (0.71) MAOBPARP10NR4A2KCNH2
SCHEMBL30984473 0.78 GRM5 (0.43) MAOBPARP10IDO1AGXTNR4A2
SCHEMBL30984470 0.78 PTPN1 (0.44) MAOBPARP10IDO1AGXTNR4A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1863804-A1 INHIBITORS OF HISTONE DEACETYLASE Methylgene, Inc. (CA) 2007-12-12 — — EP claimed
WO-2006102760-A1 INHIBITORS OF HISTONE DEACETYLASE METHYLGENE INC. (CA) 2006-10-05 — — WO claimed
WO-2007143822-A1 SULFAMIDE AND SULFAMATE DERIVATIVES AS HISTONE DEACETYLASE INHIBITORS METHYLGENE INC. (CA) 2007-12-21 — — WO disclosed
US-20060264415-A1 Inhibitors of histone deacetylase METHYLGENE INC. 2006-11-23 — — US disclosed
WO-2006102760-A1 INHIBITORS OF HISTONE DEACETYLASE METHYLGENE INC. (CA) 2006-10-05 — — 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-20060264415-A1 Inhibitors of histone deacetylase HDAC1, HDAC3, HDAC11 MAOB 750/4885PARP10 248/4885IDO1 1132/4885

“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.

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