SCHEMBL14200026

SCHEMBL14200026

CC(C)c1ccc(OCc2ccccc2)c(N)c1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.45
L3MBTL1 Q9Y468 2/20 0.45
RAB9A P51151 2/20 0.45
GAA P10253 2/20 0.45
MAOB P27338 2/20 0.45
MAPK1 P28482 1/20 0.45
TDP1 Q9NUW8 1/20 0.45
MAOA P21397 1/20 0.45
SMN1; SMN2 Q16637 1/20 0.45
APP P05067 1/20 0.44
LTA4H P09960 1/20 0.44
MAPK14 Q16539 1/20 0.44
CCR5 P51681 1/20 0.44
ALDH1A1 P00352 2/20 0.43
GLRA1 P23415 1/20 0.43
IDO1 P14902 2/20 0.42
ALOX12 P18054 1/20 0.42
HTT P42858 1/20 0.42
HIF1A Q16665 1/20 0.42
MRGPRX4 Q96LA9 1/20 0.42

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
SCHEMBL14200018 0.88 MAPT (0.45) MAPTL3MBTL1RAB9AGAAMAOB
SCHEMBL682767 0.85 MAPT (0.49) MAPTL3MBTL1RAB9AGAAMAPK1
SCHEMBL27581482 0.84 ALOX5 (0.45) MAPTL3MBTL1RAB9ATDP1SMN1; SMN2
SCHEMBL27581483 0.84 RAB9A (0.41) MAPTL3MBTL1RAB9AMAPK1TDP1
SCHEMBL12889910 0.83 GLRA1 (0.50) MAPTL3MBTL1RAB9AMAPK1TDP1
SCHEMBL12868786 0.83 FFAR4 (0.54) MAPTL3MBTL1RAB9AMAPK1TDP1
SCHEMBL24313779 0.81 FFAR1 (0.52) MAPTL3MBTL1RAB9AMAPK1TDP1
SCHEMBL12738664 0.81 NPC1 (0.55) MAPTRAB9AGAASMN1; SMN2APP
SCHEMBL17833745 0.81 SMPD1 (0.53) RAB9AGAAMAPK1SMN1; SMN2APP
SCHEMBL10172543 0.81 NPC1 (0.52) MAPTL3MBTL1RAB9AMAPK1TDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-111164074-B Heat shock protein 90 inhibitors 台北医学大学 2024-02-02 CN disclosed
CN-111164074-A Heat shock protein 90 inhibitor 台北医学大学 2020-05-15 CN disclosed
EP-3601226-A1 HEAT SHOCK PROTEIN 90 INHIBITORS Taipei Medical University (TW) 2020-02-05 EP disclosed
WO-2018171575-A1 HEAT SHOCK PROTEIN 90 INHIBITORS TAIPEI MEDICAL UNIVERSITY (CN) 2018-09-27 WO disclosed
US-8778874-B2 Glycopeptide antibiotic monomer derivatives NATIONAL UNIVERSITY CORPORATION NAGOYA UNIVERSITY (JP) 2014-07-15 US disclosed
US-20080097078-A1 Antibacterial activity against vancomycin-resistant bacteria SHIONOGI & CO., LTD. (JP) 2008-04-24 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-20080097078-A1 Antibacterial activity against vancomycin-resistant bacteria CSGALNACT1, MON2, NR2C2 MAPT 4669/4885L3MBTL1 3585/4885RAB9A 2738/4885

“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.