SCHEMBL14769357

SCHEMBL14769357

CCc1ccc(C(=O)/C=C/c2ccc(OC)cc2OC)c(O)c1

nearest known ligand 0.80

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 6/20 0.80
NPC1 O15118 3/20 0.80
MEN1 O00255 3/20 0.80
KMT2A Q03164 3/20 0.80
RAB9A P51151 2/20 0.80
MAPK1 P28482 2/20 0.80
APP P05067 3/20 0.67
CHRNA7 P36544 1/20 0.65
L3MBTL1 Q9Y468 1/20 0.61
KDM4E B2RXH2 1/20 0.60
PTPN1 P18031 1/20 0.59
TNFRSF1A P19438 1/20 0.58
PDE4A P27815 1/20 0.57
PDE4B Q07343 1/20 0.57
PDE4C Q08493 1/20 0.57
PDE4D Q08499 1/20 0.57
ALDH1A1 P00352 2/20 0.56
SMN1; SMN2 Q16637 2/20 0.56
ABCG2 Q9UNQ0 3/20 0.56
FLT3 P36888 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
SCHEMBL634357 0.89 MAPT (1.00) MAPTNPC1MEN1KMT2ARAB9A
SCHEMBL634358 0.89 MAPT (1.00) MAPTNPC1MEN1KMT2ARAB9A
SCHEMBL28681178 0.87 MAPT (0.95) MAPTNPC1MEN1KMT2ARAB9A
SCHEMBL9425399 0.86 MAPT (0.84) MAPTNPC1MEN1KMT2ARAB9A
SCHEMBL9425402 0.86 MAPT (0.84) MAPTNPC1MEN1KMT2ARAB9A
SCHEMBL28390756 0.83 MAPT (0.82) MAPTNPC1MEN1KMT2ARAB9A
SCHEMBL28390757 0.83 MAPT (0.82) MAPTNPC1MEN1KMT2ARAB9A
SCHEMBL2462050 0.82 MAPT (1.00) MAPTNPC1MEN1KMT2ARAB9A
SCHEMBL2462049 0.82 MAPT (1.00) MAPTNPC1MEN1KMT2ARAB9A
SCHEMBL632910 0.82 MAPT (0.81) MAPTNPC1MEN1KMT2ARAB9A

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-9101600-B2 Compounds as RORγt modulators and uses thereof NEW YORK UNIVERSITY (US) 2015-08-11 US disclosed
US-20130065842-A1 COMPOUNDS AS RORyT MODULATORS AND USES THEREOF THE UNITED STATES OF AMERICA, AS REPRESENTED BY THE SECRETARY, DEPARTMENT OF HEALTH AND HUMAN SERVICES 2013-03-14 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-20130065842-A1 COMPOUNDS AS RORyT MODULATORS AND USES THEREOF RORC, RORB, RORA MAPT 3323/4885NPC1 1496/4885MEN1 2318/4885

“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.