SCHEMBL6595219

SCHEMBL6595219

Cc1cccc2[nH]c(C(N)=O)c(C)c12

nearest known ligand 0.46

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
MAP2 P11137 3/20 0.42
PARP1 P09874 2/20 0.41
ALDH1A1 P00352 4/20 0.38
MAPT P10636 2/20 0.38
KDM4E B2RXH2 2/20 0.38
DAO P14920 2/20 0.37
MET P08581 1/20 0.36
DDO Q99489 1/20 0.36
HSD17B10 Q99714 3/20 0.36
GPR84 Q9NQS5 1/20 0.35

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
SCHEMBL15516976 0.84 MCL1 (0.44) ALDH1A1MAPTKDM4EDAO
Urea SCHEMBL27364794 0.81 AHR (0.41) PARP1ALDH1A1MAPTDAOMET
SCHEMBL7641382 0.76 NR4A2 (0.41) PARP1ALDH1A1MAPTDAOMET
SCHEMBL4493831 0.75 MAP2 (0.60) MAP2ALDH1A1MAPTKDM4EDAO
SCHEMBL20886859 0.72 CYP1A2 (0.41) PARP1ALDH1A1KDM4EDAODDO
SCHEMBL1921411 0.71 AHR (0.50) PARP1MAPTKDM4EDAOGPR84
Urea SCHEMBL27376718 0.71 BTK (0.39) ALDH1A1MAPTKDM4EMETHSD17B10
SCHEMBL19639028 0.71 DAO (0.47) PARP1ALDH1A1MAPTKDM4EDAO
SCHEMBL8796482 0.70 PIM1 (0.46) MAP2ALDH1A1MAPTKDM4EHSD17B10
SCHEMBL9435028 0.70 MAP2 (0.47) MAP2ALDH1A1MAPTKDM4EHSD17B10

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
US-11479558-B2 Substituted tetrahydropyranoindoles, derivatives thereof, and their methods of synthesis and use NORTHWESTERN UNIVERSITY (US) 2022-10-25 US disclosed
EP-3044207-A1 INDOL-CARBOXAMIDE DERIVATIVES F. Hoffmann-La Roche AG (CH) 2016-07-20 EP disclosed
WO-2015036412-A1 INDOL-CARBOXAMIDE DERIVATIVES F. HOFFMANN-LA ROCHE AG (CH) 2015-03-19 WO disclosed
EP-1171428-A4 FAB I INHIBITORS AFFINIUM PHARM INC (CA) 2004-09-15 EP disclosed
EP-1171428-A1 FAB I INHIBITORS SmithKline Beecham Corporation (US) 2002-01-16 EP disclosed
WO-2000063187-A1 FAB I INHIBITORS SMITHKLINE BEECHAM CORPORATION (US) 2000-10-26 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-11479558-B2 Substituted tetrahydropyranoindoles, derivatives thereof, and their methods of synthesis and use HPGDS, SYVN1, PTGIS MAP2 3693/4885PARP1 1015/4885ALDH1A1 1724/4885

“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.