SCHEMBL9967773

SCHEMBL9967773

CC(C)/C=C/c1ccc(N(C)C)cc1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
APP P05067 4/20 0.59
RELA Q04206 1/20 0.57
MAPT P10636 6/20 0.55
MEN1 O00255 4/20 0.55
KMT2A Q03164 4/20 0.55
CASP1 P29466 2/20 0.55
HBB P68871 2/20 0.55
GAA P10253 1/20 0.55
BRCA1 P38398 1/20 0.55
CASP7 P55210 1/20 0.55
SMN1; SMN2 Q16637 3/20 0.53
ALOX15 P16050 2/20 0.53
NPC1 O15118 2/20 0.53
RAB9A P51151 2/20 0.53
HSD17B3 P37058 1/20 0.52
KDM4E B2RXH2 1/20 0.52
ALDH1A1 P00352 3/20 0.50
LMNA P02545 2/20 0.50
PTGS1 P23219 1/20 0.50
ALPG P10696 1/20 0.50

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
SCHEMBL22359184 0.83 APP (0.57) APPRELAMAPTMEN1KMT2A
SCHEMBL1714446 0.81 RELA (0.81) APPRELAMAPTMEN1KMT2A
SCHEMBL3025040 0.81 RELA (0.81) APPRELAMAPTMEN1KMT2A
SCHEMBL1714449 0.81 RELA (0.81) APPRELAMAPTMEN1KMT2A
SCHEMBL13467434 0.81 RELA (0.81) APPRELAMAPTMEN1KMT2A
SCHEMBL7915381 0.81 RELA (0.81) APPRELAMAPTMEN1KMT2A
SCHEMBL24740555 0.81 APP (0.59) APPRELAMAPTMEN1KMT2A
SCHEMBL10411806 0.81 APP (0.59) APPRELAMAPTMEN1KMT2A
SCHEMBL10411804 0.81 APP (0.59) APPRELAMAPTMEN1KMT2A
SCHEMBL29389358 0.79 RELA (0.77) APPRELAMAPTMEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20220153732-A1 PROTEIN SECRETION INHIBITORS ENODIA THERAPEUTICS SAS (FR) 2022-05-19 US disclosed
US-20150173359-A1 SUBSTITUTED FUSED PYRIMIDINONES AND DIHYDROPYRIMIDINONES BAYER IP GMBH (DE) 2015-06-25 US disclosed
US-20150173359-A1 SUBSTITUTED FUSED PYRIMIDINONES AND DIHYDROPYRIMIDINONES BAYER IP GMBH (DE) 2015-06-25 US disclosed
US-9006265-B2 Substituted fused pyrimidinones and dihydropyrimidinones BAYER INTELLECTUAL PROPERTY GMBH (DE) 2015-04-14 US disclosed
US-9006265-B2 Substituted fused pyrimidinones and dihydropyrimidinones BAYER INTELLECTUAL PROPERTY GMBH (DE) 2015-04-14 US disclosed
US-20120157306-A1 Substituted Fused Pyrimidinones and Dihydropyrimidinones BAYER CROPSCIENCE AG (DE) 2012-06-21 US disclosed
US-7919521-B2 Five-membered iminocyclitol derivatives as selective and potent glycosidase inhibitors: new structures for antivirals and osteoarthritis therapeutics ACADEMIA SINICA (TW) 2011-04-05 US disclosed
US-20090306174-A1 Novel Five-Membered Iminocyclitol Derivatives as Selective and Potent Glycosidase Inhibitors: New Structures for Antivirals and Osteoarthritis Therapeutics ACADEMIA SINICA (TW) 2009-12-10 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 (4 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-20150173359-A1 SUBSTITUTED FUSED PYRIMIDINONES AND DIHYDROPYRIMIDINONES DHPS, FDPS, DPYD APP 4313/4885RELA 1494/4885MAPT 3143/4885
US-20090306174-A1 Novel Five-Membered Iminocyclitol Derivatives as Selective and Potent Glycosidase Inhibitors: New Structures for Antivirals and Osteoarthritis Therapeutics ACE2, ENGASE, DPP7 APP 931/4885RELA 1508/4885MAPT 1432/4885
US-20120157306-A1 Substituted Fused Pyrimidinones and Dihydropyrimidinones DHPS, FDPS, DPYD APP 4313/4885RELA 1494/4885MAPT 3143/4885
US-20220153732-A1 PROTEIN SECRETION INHIBITORS SEC61B, SEC61A1, SEC61G APP 1622/4885RELA 2509/4885MAPT 2487/4885

“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.