SCHEMBL15847129

SCHEMBL15847129

O=[N+]([O-])c1ccc(C(c2ccc[nH]2)c2ccc[nH]2)cc1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 6/20 0.51
MAPT P10636 5/20 0.51
CYP1A2 P05177 1/20 0.51
CYP3A4 P08684 1/20 0.51
TSHR P16473 1/20 0.51
MAPK1 P28482 1/20 0.51
PHLPP2 Q6ZVD8 1/20 0.51
TDP1 Q9NUW8 1/20 0.51
ALDH1A1 P00352 8/20 0.45
GAA P10253 4/20 0.45
KDM4E B2RXH2 4/20 0.45
MEN1 O00255 5/20 0.42
KMT2A Q03164 5/20 0.42
LMNA P02545 4/20 0.42
HPGD P15428 2/20 0.42
BLM P54132 2/20 0.42
PSMD14 O00487 1/20 0.42
MMP2 P08253 1/20 0.42
ALOX12 P18054 1/20 0.42
NFKB1 P19838 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
SCHEMBL7467600 0.85 L3MBTL1 (0.46) L3MBTL1MAPTCYP1A2CYP3A4TSHR
SCHEMBL18184934 0.83 CA12 (0.47) L3MBTL1MAPTCYP1A2CYP3A4TSHR
SCHEMBL18184933 0.81 L3MBTL1 (0.42) L3MBTL1MAPTCYP1A2CYP3A4TSHR
SCHEMBL1047553 0.81 MAPT (0.70) L3MBTL1MAPTCYP1A2CYP3A4TSHR
SCHEMBL14322127 0.81 SLC6A2 (0.32) KMT2AATM
SCHEMBL27736617 0.80 CNR1 (0.50) L3MBTL1MAPTCYP1A2CYP3A4TSHR
SCHEMBL27736616 0.80 CNR1 (0.50) L3MBTL1MAPTCYP1A2CYP3A4TSHR
SCHEMBL3695529 0.77 ALDH1A1 (0.62) L3MBTL1MAPTCYP1A2CYP3A4TSHR
SCHEMBL270836 0.73 SLC6A2 (0.44) TSHRKMT2AATM
SCHEMBL14528752 0.72 AURKA (0.34) MAPTCYP3A4TDP1MEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118878853-A Synthesis method and application of porphyrin metal organic framework-based nanomaterial catalyst 安阳工学院 2024-11-01 CN disclosed
EP-2938619-B1 MEGASTOKES AMINO-TRIAZOLYL-BODIPY COMPOUNDS AND APPLICATIONS TO LIVE NEURON STAINING AND HUMAN SERUM ALBUMIN FA1 DRUG SITE PROBING NAT UNIV SINGAPORE (SG) 2018-02-21 EP disclosed
US-9513294-B2 Megastokes amino-triazolyl-BODIPY compounds and applications to live neuron staining and human serum albumin FA1 drug site probing NATIONAL UNIVERSITY OF SINGAPORE (SG) 2016-12-06 US disclosed
US-9513294-B2 Megastokes amino-triazolyl-BODIPY compounds and applications to live neuron staining and human serum albumin FA1 drug site probing NATIONAL UNIVERSITY OF SINGAPORE (SG) 2016-12-06 US disclosed
US-9513294-B2 Megastokes amino-triazolyl-BODIPY compounds and applications to live neuron staining and human serum albumin FA1 drug site probing NATIONAL UNIVERSITY OF SINGAPORE (SG) 2016-12-06 US disclosed
EP-2938619-A1 MEGASTOKES AMINO-TRIAZOLYL-BODIPY COMPOUNDS AND APPLICATIONS TO LIVE NEURON STAINING AND HUMAN SERUM ALBUMIN FA1 DRUG SITE PROBING National University of Singapore (SG) 2015-11-04 EP disclosed
US-20150309040-A1 Megastokes Amino-Triazolyl-Bodipy Compounds And Applications To Live Neuron Staining And Human Serum Albumin FA1 Drug Site Probing AGENCY FOR SCIENCE, TECHNOLOGY AND RESEARCH (SG) 2015-10-29 US disclosed
US-20150309040-A1 Megastokes Amino-Triazolyl-Bodipy Compounds And Applications To Live Neuron Staining And Human Serum Albumin FA1 Drug Site Probing AGENCY FOR SCIENCE, TECHNOLOGY AND RESEARCH (SG) 2015-10-29 US disclosed
US-20150309040-A1 Megastokes Amino-Triazolyl-Bodipy Compounds And Applications To Live Neuron Staining And Human Serum Albumin FA1 Drug Site Probing AGENCY FOR SCIENCE, TECHNOLOGY AND RESEARCH (SG) 2015-10-29 US disclosed
WO-2014104975-A1 MEGASTOKES AMINO-TRIAZOLYL-BODIPY COMPOUNDS AND APPLICATIONS TO LIVE NEURON STAINING AND HUMAN SERUM ALBUMIN FA1 DRUG SITE PROBING NATIONAL UNIVERSITY OF SINGAPORE (SG) 2014-07-03 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-20150309040-A1 Megastokes Amino-Triazolyl-Bodipy Compounds And Applications To Live Neuron Staining And Human Serum Albumin FA1 Drug Site Probing FABP7, FABP1, FABP3 L3MBTL1 932/4885MAPT 540/4885CYP1A2 3107/4885

“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.