SCHEMBL10148164

SCHEMBL10148164

COc1ccc(CNc2nc(-c3cccc([N+](=O)[O-])c3)cs2)cc1OC

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMO O15229 1/20 0.67
MAPT P10636 6/20 0.62
RAB9A P51151 2/20 0.62
RECQL P46063 1/20 0.62
MEN1 O00255 3/20 0.60
KMT2A Q03164 3/20 0.60
ALDH1A1 P00352 3/20 0.58
KDM4E B2RXH2 1/20 0.58
MAOA P21397 9/20 0.57
MAOB P27338 9/20 0.57
CSNK2A1 P68400 1/20 0.57
GAA P10253 1/20 0.56
CYP1A2 P05177 1/20 0.55
CYP3A4 P08684 1/20 0.55
CYP2D6 P10635 1/20 0.55
CYP2C9 P11712 1/20 0.55
CYP2C19 P33261 1/20 0.55
SMN1; SMN2 Q16637 1/20 0.55
MAPK1 P28482 1/20 0.54
VCP P55072 1/20 0.54

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
SCHEMBL10148173 0.81 MAOA (0.55) MAPTRAB9ARECQLMEN1KMT2A
SCHEMBL424256 0.80 KMO (1.00) KMOMAPTRAB9ARECQLMEN1
SCHEMBL29379527 0.80 KMO (1.00) KMOMAPTRAB9ARECQLMEN1
SCHEMBL10148150 0.80 KMO (0.56) KMOMAPTRAB9ARECQLMEN1
SCHEMBL17146456 0.80 KMO (0.66) KMOMAPTRAB9ARECQLMEN1
SCHEMBL10148130 0.79 KMO (0.71) KMOMAPTRAB9AMEN1KMT2A
SCHEMBL14293384 0.78 KMO (0.64) KMOMAPTRAB9ARECQLMEN1
SCHEMBL6198481 0.78 KMO (0.64) KMOMAPTRAB9ARECQLMEN1
SCHEMBL10148109 0.78 KMO (0.57) KMOMAPTRAB9AMEN1KMT2A
SCHEMBL10148156 0.78 KMO (0.54) 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.