SCHEMBL7469754

SCHEMBL7469754

CNc1cc2ccccc2cc1N

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PRKCI P41743 1/20 0.41
IDO1 P14902 1/20 0.41
ALDH1A1 P00352 4/20 0.39
HSD17B10 Q99714 4/20 0.39
CYP3A4 P08684 4/20 0.39
TDP1 Q9NUW8 3/20 0.38
ALOX15 P16050 2/20 0.38
CASP1 P29466 2/20 0.38
CASP7 P55210 2/20 0.38
HBB P68871 1/20 0.38
HIF1A Q16665 1/20 0.38
POLB P06746 2/20 0.37
HPGD P15428 2/20 0.37
L3MBTL1 Q9Y468 2/20 0.37
KDM4E B2RXH2 1/20 0.37
USP2 O75604 1/20 0.37
MAPT P10636 1/20 0.37
RECQL P46063 1/20 0.37
NPSR1 Q6W5P4 1/20 0.37
NUDT1 P36639 1/20 0.36

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
SCHEMBL5605449 0.85 PRKCI (0.42) PRKCINUDT1
SCHEMBL5605028 0.85 PRKCI (0.42) PRKCINUDT1
SCHEMBL5606146 0.83 PRKCI (0.41) PRKCI
SCHEMBL21154375 0.83 PRKCI (0.41) PRKCI
SCHEMBL5605747 0.83 PRKCI (0.41) PRKCI
SCHEMBL10829034 0.83 TDP1 (0.44) IDO1ALDH1A1HSD17B10TDP1POLB
SCHEMBL14320079 0.79 IDO1 (0.42) IDO1ALDH1A1HSD17B10CYP3A4TDP1
SCHEMBL5084584 0.77 PRKCI (0.46) PRKCIALDH1A1HSD17B10CYP3A4TDP1
SCHEMBL23626051 0.75 IDO1 (0.41) PRKCIIDO1ALDH1A1HSD17B10CYP3A4
SCHEMBL5085231 0.75 PRKCI (0.45) PRKCIALDH1A1HSD17B10CYP3A4ALOX15

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-20230337534-A1 NITROGEN-CONTAINING COMPOUND, AND ORGANIC ELECTROLUMINESCENT DEVICE AND ELECTRONIC APPARATUS THEREOF SHAANXI LIGHTE OPTOELECTRONICS MATERIAL CO., LTD. (CN) 2023-10-19 US disclosed
US-9818959-B2 Metal-assisted delayed fluorescent emitters containing tridentate ligands Arizona Board of Regents on behlaf of Arizona State University (US) 2017-11-14 US disclosed
WO-2012019106-A2 POSITIVE AND NEGATIVE MODULATORS OF NMDA RECEPTORS BOARD OF REGENTS OF THE UNIVERSITY OF NEBRASKA (US) 2012-02-09 WO disclosed
US-8017774-B2 Producing method for iridium complex CANON KABUSHIKI KAISHA (JP) 2011-09-13 US disclosed
EP-1089999-A4 (HETEROCYCLIC) METHYL SUBSTITUTED CARBAPENEM ANTIBACTERIALS MERCK & CO INC (US) 2002-12-04 EP disclosed
US-6291448-B1 CARBAPENEM NUCLEUS IS SUBSTITUTED AT THE 2-POSITION WITH FUSED BI- AND TRICYCLIC 2,2-DIOXO-3-X-2-THIA-1-AZA-CYCLOPENTA RING SYSTEMS LINKED THROUGH A CH2 GROUP. MERCK & CO., INC. 2001-09-18 US disclosed
EP-1089999-A1 (HETEROCYCLIC) METHYL SUBSTITUTED CARBAPENEM ANTIBACTERIALS Merck & Co., Inc. (US) 2001-04-11 EP disclosed
WO-1999067241-A1 (HETEROCYCLIC) METHYL SUBSTITUTED CARBAPENEM ANTIBACTERIALS MERCK & CO., INC. (US) 1999-12-29 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-20230337534-A1 NITROGEN-CONTAINING COMPOUND, AND ORGANIC ELECTROLUMINESCENT DEVICE AND ELECTRONIC APPARATUS THEREOF NUDC, SLC29A2, SLC6A19 PRKCI 4462/4885IDO1 3311/4885ALDH1A1 3779/4885

“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.