SCHEMBL2899323

SCHEMBL2899323

Brc1ccc(Oc2cc[c]cn2)cc1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 1/20 0.39
LTA4H P09960 2/20 0.37
THRB P10828 1/20 0.35
MMP13 P45452 1/20 0.33
PTGS2 P35354 1/20 0.33
MEN1 O00255 2/20 0.32
KMT2A Q03164 2/20 0.32
KDM4E B2RXH2 1/20 0.32
GLA P06280 1/20 0.31
MAPK1 P28482 1/20 0.31
HTT P42858 1/20 0.31
TDP1 Q9NUW8 1/20 0.31
ALDH1A1 P00352 1/20 0.31
TSHR P16473 1/20 0.31
MAOA P21397 1/20 0.31
MAOB P27338 1/20 0.31
TTBK1 Q5TCY1 1/20 0.31
TTBK2 Q6IQ55 1/20 0.31
ABCG2 Q9UNQ0 1/20 0.30
APP P05067 1/20 0.30

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
SCHEMBL2903058 0.81 MEN1 (0.44) MAPTLTA4HMEN1KMT2AKDM4E
SCHEMBL2894972 0.81 MEN1 (0.52) MAPTMEN1KMT2AKDM4EHTT
SCHEMBL1712271 0.81 MEN1 (0.50) MMP13MEN1KMT2AKDM4EHTT
SCHEMBL2901814 0.81 L3MBTL1 (0.44) MAPTLTA4HMEN1KMT2AKDM4E
SCHEMBL315475 0.81 ALDH1A1 (0.43) MAPTLTA4HMEN1KMT2AKDM4E
SCHEMBL2903041 0.79 MAP4K4 (0.43) MAPTMEN1KMT2AKDM4EMAPK1
SCHEMBL10393907 0.79 NPC1 (0.40) MAPTLTA4HMEN1KMT2AMAPK1
SCHEMBL2903371 0.77 SCN5A (0.37) MAPT
SCHEMBL2901946 0.77 RAB9A (0.54) MAPTMEN1KMT2AKDM4EMAPK1
SCHEMBL2894791 0.77 MAPT (0.43) MAPTLTA4HTHRBKDM4EMAPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100305124-A1 Acylated Aminopyridine and Aminopyridazine Insecticides BAYER CROPSCIENCE AG (DE) 2010-12-02 US disclosed
EP-2236505-A1 Acylated aminopyridines and pyridazines as insecticides Bayer CropScience AG (DE) 2010-10-06 EP disclosed
US-4954497-A AGRICULTURE TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1990-09-04 US disclosed
EP-0330939-A2 Acrylic acid morpholides, their production and use Takeda Chemical Industries, Ltd. (JP) 1989-09-06 EP 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-20100305124-A1 Acylated Aminopyridine and Aminopyridazine Insecticides AAAS, DDT, QDPR MAPT 3480/4885LTA4H 1914/4885THRB 3726/4885

“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.