SCHEMBL3412563

SCHEMBL3412563

CCOc1cc(CNc2ccc(C)c(C)c2)ccc1OC

nearest known ligand 0.66

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 8/20 0.66
ALDH1A1 P00352 5/20 0.66
KDM4E B2RXH2 4/20 0.66
GAA P10253 4/20 0.64
LMNA P02545 3/20 0.64
NPC1 O15118 3/20 0.64
TDP1 Q9NUW8 2/20 0.64
MEN1 O00255 2/20 0.64
KMT2A Q03164 2/20 0.64
TSHR P16473 2/20 0.64
ALOX15 P16050 1/20 0.64
MAPK1 P28482 1/20 0.64
HTT P42858 1/20 0.64
GFER P55789 1/20 0.64
APAF1 O14727 1/20 0.61
RAB9A P51151 3/20 0.59
L3MBTL1 Q9Y468 3/20 0.59
F2 P00734 1/20 0.56
F10 P00742 1/20 0.56
PRSS1 P07477 1/20 0.56

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
SCHEMBL3410940 0.82 MAPT (0.65) MAPTALDH1A1KDM4EGAALMNA
SCHEMBL14886127 0.80 ALDH1A1 (0.65) MAPTALDH1A1KDM4EGAALMNA
SCHEMBL11244650 0.79 F2 (0.63) MAPTALDH1A1KDM4EGAALMNA
SCHEMBL2343438 0.79 MAPT (1.00) MAPTALDH1A1KDM4EGAALMNA
SCHEMBL11248949 0.78 L3MBTL1 (0.76) MAPTALDH1A1KDM4EGAATDP1
SCHEMBL3117592 0.76 MAPT (0.58) MAPTALDH1A1KDM4EGAALMNA
SCHEMBL3409542 0.75 MAPT (0.50) MAPTALDH1A1KDM4EGAALMNA
SCHEMBL1223575 0.75 KDM4E (0.53) MAPTALDH1A1KDM4EGAAMEN1
SCHEMBL3412013 0.73 MAPT (0.58) MAPTALDH1A1KDM4EGAALMNA
SCHEMBL11030253 0.72 CALM1 (0.56) MAPTALDH1A1KDM4EGAAKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20130101684-A1 Compounds, Compositions, And Methods For Reducing Or Eliminating Bitter Taste CHROMOCELL CORPORATION (US) 2013-04-25 US disclosed
WO-2011130707-A9 COMPOUNDS, COMPOSITIONS, AND METHODS FOR REDUCING OR ELIMINATING BITTER TASTE CHROMOCELL CORPORATION (US) 2012-01-05 WO disclosed
WO-2011130707-A2 COMPOUNDS, COMPOSITIONS, AND METHODS FOR REDUCING OR ELIMINATING BITTER TASTE CHROMOCELL CORPORATION (US) 2011-10-20 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-20130101684-A1 Compounds, Compositions, And Methods For Reducing Or Eliminating Bitter Taste TAS2R5, TAS2R20, TAS2R10 MAPT 4340/4885ALDH1A1 1771/4885KDM4E 2256/4885

“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.