SCHEMBL24175752

SCHEMBL24175752

C1=CC2Oc3ccc(-c4c5ccccc5c(-c5cccc6ccccc56)c5ccccc45)cc3C2C=C1

nearest known ligand 0.34

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
GABRA1 P14867 1/20 0.31
GABRG2 P18507 1/20 0.31
GABRB3 P28472 1/20 0.31
ALOX5 P09917 1/20 0.31
EDNRB P24530 1/20 0.31
EDNRA P25101 1/20 0.31
KDM4E B2RXH2 1/20 0.30
ALDH1A1 P00352 1/20 0.30
CYP1A2 P05177 1/20 0.30
CYP2C19 P33261 1/20 0.30
RAB9A P51151 1/20 0.30
ATM Q13315 1/20 0.30
HSD17B10 Q99714 1/20 0.30
TYMP P19971 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
SCHEMBL25781415 0.95 CA12 (0.33)
SCHEMBL4194210 0.94 EDNRB (0.32) GABRA1GABRG2GABRB3EDNRBEDNRA
SCHEMBL13447366 0.92 CA12 (0.34) EDNRBEDNRA
SCHEMBL12640650 0.90 CA12 (0.32) KDM4EALDH1A1ATMHSD17B10
SCHEMBL24177858 0.90 SIRT2 (0.30)
SCHEMBL13447248 0.87 CA12 (0.34) EDNRBEDNRA
SCHEMBL24973903 0.86 PDE9A (0.33) GABRA1GABRG2GABRB3ALOX5CYP1A2
SCHEMBL13447247 0.86 CA12 (0.35) EDNRBEDNRA
SCHEMBL24599931 0.85 KDM4E (0.31) KDM4E
SCHEMBL179257 0.85 HSD17B1 (0.35) GABRA1GABRG2GABRB3ALOX5

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11800785-B2 Material for organic device and organic electroluminescent device using the same KWANSEI GAKUIN EDUCATIONAL FOUNDATION (JP) 2023-10-24 US disclosed
US-20220006012-A1 MATERIAL FOR ORGANIC DEVICE AND ORGANIC ELECTROLUMINESCENT DEVICE USING THE SAME KWANSEI GAKUIN EDUCATIONAL FOUNDATION (JP) 2022-01-06 US 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 (2 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-11800785-B2 Material for organic device and organic electroluminescent device using the same RER1, LEF1, CHRM1 GABRA1 3748/4885GABRG2 4451/4885GABRB3 4683/4885
US-20220006012-A1 MATERIAL FOR ORGANIC DEVICE AND ORGANIC ELECTROLUMINESCENT DEVICE USING THE SAME RER1, LEF1, CHRM1 GABRA1 3748/4885GABRG2 4451/4885GABRB3 4683/4885

“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.