SCHEMBL10148097

SCHEMBL10148097

COc1ccc(CN(CN2CCCCC2)c2nc(-c3cccc([N+](=O)[O-])c3)cs2)cc1OC

nearest known ligand 0.49

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
KMO O15229 2/20 0.49
MAPT P10636 5/20 0.45
RAB9A P51151 2/20 0.45
RECQL P46063 1/20 0.45
MEN1 O00255 1/20 0.44
KMT2A Q03164 1/20 0.44
F2R P25116 1/20 0.43
ALDH1A1 P00352 2/20 0.43
KDM4E B2RXH2 1/20 0.43
MAOA P21397 4/20 0.42
MAOB P27338 4/20 0.42
MYD88 Q99836 1/20 0.42
ACHE P22303 1/20 0.40
NPC1 O15118 1/20 0.40
LMNA P02545 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
CSNK2A1 P68400 1/20 0.40

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
SCHEMBL10148132 0.99 KMO (0.49) KMOMAPTRAB9ARECQLMEN1
SCHEMBL10148140 0.94 KMO (0.49) KMOMAPTRAB9ARECQLMEN1
SCHEMBL10148139 0.93 KMO (0.48) KMOMAPTRAB9ARECQLMEN1
SCHEMBL10148137 0.92 KMO (0.47) KMOMAPTRAB9ARECQLMEN1
SCHEMBL10148167 0.86 KMO (0.54) KMOMAPTRAB9ARECQLMEN1
SCHEMBL10148168 0.86 KMO (0.54) KMOMAPTRAB9ARECQLMEN1
SCHEMBL10148131 0.85 KMO (0.53) KMOMAPTRAB9ARECQLMEN1
SCHEMBL424436 0.84 KMO (0.57) KMOMAPTRAB9ARECQLMEN1
SCHEMBL10148142 0.83 KMO (0.51) KMOMAPTRAB9ARECQLMEN1
SCHEMBL424462 0.83 KMO (0.58) KMOMAPTRAB9ARECQLMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8710237-B2 Small molecule inhibitors of kynurenine-3-monooxygenase THE J. DAVID GLADSTONE INSTITUTE (US) 2014-04-29 US disclosed
US-20120022052-A1 SMALL MOLECULE INHIBITORS OF KYNURENINE-3-MONOOXYGENASE THE J. DAVID GLADSTONE INSTITUTES, A TESTAMENTARY TRUST ESTABLISHED UNDER 2012-01-26 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-20120022052-A1 SMALL MOLECULE INHIBITORS OF KYNURENINE-3-MONOOXYGENASE KMO, KYNU, TDO2 KMO 1/4885MAPT 898/4885RAB9A 4373/4885

“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.