SCHEMBL19084553

SCHEMBL19084553

COc1ccc(-c2c(C)nn3c(=O)cc(-c4ccc([N+](=O)[O-])cc4)[nH]c23)cc1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 5/20 0.54
HTT P42858 3/20 0.54
MEN1 O00255 2/20 0.54
LMNA P02545 2/20 0.54
KMT2A Q03164 2/20 0.54
KDM4E B2RXH2 1/20 0.54
PSD A5PKW4 5/20 0.50
SMN1; SMN2 Q16637 4/20 0.44
NPC1 O15118 2/20 0.43
RAB9A P51151 2/20 0.43
GAA P10253 1/20 0.43
NFKB1 P19838 1/20 0.43
MAPK1 P28482 1/20 0.43
STAT1 P42224 1/20 0.43
NPBWR1 P48145 1/20 0.43
NFKB2 Q00653 1/20 0.43
RELA Q04206 1/20 0.43
SAE1 Q9UBE0 1/20 0.43
UBA2 Q9UBT2 1/20 0.43
APP P05067 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
SCHEMBL19084539 0.89 PSD (0.52) MAPTHTTMEN1LMNAKMT2A
SCHEMBL19084552 0.88 PSD (0.53) MAPTHTTMEN1LMNAKMT2A
SCHEMBL19084536 0.87 PSD (0.48) MAPTHTTMEN1LMNAKMT2A
SCHEMBL13516359 0.87 PSD (0.48) MAPTHTTMEN1LMNAKMT2A
SCHEMBL19084648 0.86 PSD (0.53) MAPTHTTMEN1LMNAKMT2A
SCHEMBL1614079 0.86 MAPT (0.51) MAPTMEN1LMNAKMT2AKDM4E
SCHEMBL13516076 0.86 MAPT (0.51) MAPTMEN1LMNAKMT2AKDM4E
SCHEMBL19084664 0.85 PSD (0.51) MAPTHTTMEN1LMNAKMT2A
SCHEMBL19084608 0.85 PSD (0.48) MAPTHTTMEN1LMNAKMT2A
SCHEMBL13516124 0.85 GCGR (0.44) MAPTMEN1KMT2AKDM4EPSD

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-10849901-B2 Arf6 inhibitors and methods of synthesis and use thereof NAVIGEN, INC. (US) 2020-12-01 US disclosed
US-20170189405-A1 ARF6 INHIBITORS AND METHODS OF SYNTHESIS AND USE THEREOF NAVIGEN, INC. (US) 2017-07-06 US disclosed
US-20170189405-A1 ARF6 INHIBITORS AND METHODS OF SYNTHESIS AND USE THEREOF NAVIGEN, INC. (US) 2017-07-06 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 (2 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-20170189405-A1 ARF6 INHIBITORS AND METHODS OF SYNTHESIS AND USE THEREOF ARF6, ARF1, ARFIP2 MAPT 2995/4885HTT 2281/4885MEN1 2915/4885
US-10849901-B2 Arf6 inhibitors and methods of synthesis and use thereof ARF6, ARF1, ARFIP2 MAPT 2995/4885HTT 2281/4885MEN1 2915/4885

“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.