SCHEMBL12238006

SCHEMBL12238006

CC(=O)Oc1ccc2c(=O)c(-c3ccccn3)coc2c1

nearest known ligand 0.69

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 12/20 0.69
NPC1 O15118 9/20 0.69
ALDH1A1 P00352 8/20 0.69
SMN1; SMN2 Q16637 7/20 0.69
RAB9A P51151 7/20 0.69
KDM4E B2RXH2 6/20 0.69
POLB P06746 4/20 0.63
TDP1 Q9NUW8 1/20 0.54
MEN1 O00255 5/20 0.52
KMT2A Q03164 5/20 0.52
MAPK1 P28482 2/20 0.52
GAA P10253 2/20 0.52
PTGS1 P23219 1/20 0.52
SLC6A2 P23975 1/20 0.52
STAT1 P42224 1/20 0.52
CASP3 P42574 1/20 0.52
HTT P42858 1/20 0.52
HIF1A Q16665 1/20 0.52
SENP8 Q96LD8 1/20 0.52
SENP7 Q9BQF6 1/20 0.52

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
SCHEMBL13856172 0.86 RAB9A (0.67) MAPTNPC1ALDH1A1SMN1; SMN2RAB9A
SCHEMBL2070406 0.82 NPC1 (1.00) MAPTNPC1ALDH1A1SMN1; SMN2RAB9A
SCHEMBL12238017 0.81 MAPT (0.74) MAPTNPC1ALDH1A1SMN1; SMN2RAB9A
SCHEMBL29395943 0.80 NPC1 (0.78) MAPTNPC1ALDH1A1SMN1; SMN2RAB9A
SCHEMBL470778 0.80 NPC1 (0.78) MAPTNPC1ALDH1A1SMN1; SMN2RAB9A
SCHEMBL1724568 0.79 MAPT (0.85) MAPTNPC1ALDH1A1SMN1; SMN2RAB9A
SCHEMBL2549638 0.79 KDM4E (0.64) MAPTNPC1ALDH1A1SMN1; SMN2RAB9A
SCHEMBL2069266 0.79 MAPT (0.84) MAPTNPC1ALDH1A1SMN1; SMN2RAB9A
SCHEMBL2069145 0.76 RAB9A (0.80) MAPTNPC1ALDH1A1SMN1; SMN2RAB9A
SCHEMBL12238020 0.76 RAB9A (0.80) MAPTNPC1ALDH1A1SMN1; SMN2RAB9A

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
US-9408826-B2 Isoflavone anti-viral compounds Kineta, Inc. (US) 2016-08-09 US disclosed
US-9408826-B2 Isoflavone anti-viral compounds Kineta, Inc. (US) 2016-08-09 US disclosed
US-20110262482-A1 ANTI-VIRAL COMPOUNDS Kineta, Inc. (US) 2011-10-27 US disclosed
US-20110262482-A1 ANTI-VIRAL COMPOUNDS Kineta, Inc. (US) 2011-10-27 US disclosed
WO-2011133728-A2 ANTI-VIRAL COMPOUNDS Kineta, Inc. (US) 2011-10-27 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-20110262482-A1 ANTI-VIRAL COMPOUNDS MAVS, EIF2AK2, IRF3 MAPT 3520/4885NPC1 1706/4885ALDH1A1 3477/4885

“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.