SCHEMBL3189059

SCHEMBL3189059

O=[C]Oc1cccc(-c2ccccc2)c1

nearest known ligand 0.47

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
SOD1 P00441 1/20 0.46
MRGPRX4 Q96LA9 1/20 0.41
GGPS1 O95749 1/20 0.41
RXRA P19793 2/20 0.41
RXRB P28702 2/20 0.41
EPHX1 P07099 1/20 0.41
FABP7 O15540 1/20 0.41
FABP3 P05413 1/20 0.41
FABP5 Q01469 1/20 0.41
MAOA P21397 1/20 0.40
LTA4H P09960 1/20 0.40

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
SCHEMBL21832137 0.89 SOD1 (0.39) SOD1EPHX1MAOA
SCHEMBL8151669 0.82 KMT2A (0.41) LTA4H
SCHEMBL1262460 0.80 CA1 (0.47)
SCHEMBL2661 0.79
SCHEMBL14480071 0.79 MAOB (0.50) MAOALTA4H
SCHEMBL16361075 0.75 LTA4H (0.55) MAOALTA4H
SCHEMBL28083240 0.75 LTA4H (0.41) MAOALTA4H
SCHEMBL7876533 0.75 SOD1 (0.54) SOD1MRGPRX4GGPS1RXRARXRB
SCHEMBL9686333 0.75 HDAC4 (0.53)
SCHEMBL11409557 0.73 LTA4H (0.52) MAOALTA4H

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117998881-A Light emitting device, light emitting apparatus, electronic device, and lighting apparatus 株式会社半导体能源研究所 2024-05-07 CN disclosed
CN-117998880-A Light emitting device 株式会社半导体能源研究所 2024-05-07 CN disclosed
US-7659416-B2 Monomolecular conductive complex, conductive self-assembled film and assembly of electrode composed of metal and semiconductor making use of the same TOKYO INSTITUTE OF TECHNOLOGY (JP) 2010-02-09 US disclosed
US-20090036698-A1 Monomolecular Conductive Complex, Conductive Self-Assembled Film and Assembly of Electrode Composed of Metal and Semiconductor Making Use of the Same TOKYO INSTITUTE OF TECHNOLOGY 2009-02-05 US disclosed
EP-1862453-A1 MONOMOLECULAR CONDUCTIVE COMPLEX, CONDUCTIVE SELF-ASSEMBLED FILM AND ASSEMBLY OF ELECTRODE COMPOSED OF METAL AND SEMICONDUCTOR MAKING USE OF THE SAME Tokyo Institute of Technology (JP) 2007-12-05 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-20090036698-A1 Monomolecular Conductive Complex, Conductive Self-Assembled Film and Assembly of Electrode Composed of Metal and Semiconductor Making Use of the Same CNTN1, GAP43, AP3M1 SOD1 45/4885MRGPRX4 4735/4885GGPS1 2627/4885

“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.