SCHEMBL26772487

SCHEMBL26772487

c1cc2ccc3c4ccccc4n4c5cccnc5[nH]c(c1)c2c34

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
IDO1 P14902 1/20 0.39
GABRA1 P14867 3/20 0.37
GABRG2 P18507 3/20 0.37
GABRB3 P28472 3/20 0.37
GABRA5 P31644 3/20 0.37
GABRA3 P34903 3/20 0.37
GABRA2 P47869 3/20 0.37
ADORA3 P0DMS8 2/20 0.37
CDK4 P11802 2/20 0.35
CCND1 P24385 2/20 0.35
AURKA O14965 2/20 0.34
ALK Q9UM73 2/20 0.34
ERBB2 P04626 2/20 0.34
PTK6 Q13882 2/20 0.34
EGFR P00533 1/20 0.34
SRC P12931 1/20 0.34
ACVR1 Q04771 1/20 0.34
AURKC Q9UQB9 1/20 0.34
DAO P14920 1/20 0.34
GABRP O00591 1/20 0.34

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
SCHEMBL26772461 0.86 GABRA1 (0.36) IDO1GABRA1GABRG2GABRB3GABRA5
SCHEMBL26772408 0.83 CDC25B (0.42) GABRA1GABRG2GABRB3GABRA5GABRA3
SCHEMBL26343896 0.78 LMNA (0.38)
SCHEMBL26772491 0.78 CDK4 (0.46) IDO1GABRA1GABRG2GABRB3GABRA5
SCHEMBL25779366 0.76 PTK6 (0.40) IDO1GABRA1GABRG2GABRB3GABRA5
SCHEMBL26824210 0.76 GABRP (0.38) GABRA1GABRG2GABRB3GABRA5GABRA3
SCHEMBL26772473 0.75 KIF11 (0.36) GABRA1GABRG2GABRB3GABRA5GABRA3
SCHEMBL24961630 0.75 GABRP (0.41) GABRA1GABRG2GABRB3GABRA5GABRA3
SCHEMBL18012343 0.74 ALDH1A1 (0.50) ERBB2
SCHEMBL26772506 0.73 CDK4 (0.41) IDO1GABRA1GABRG2GABRB3GABRA5

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-20230380280-A1 ORGANIC COMPOUNDS, MIXTURES AND APPLICATIONS THEREOF IN ORGANIC ELECTRONIC DEVICES Zhejiang Brilliant Optoelectronic Technology Co.,Ltd. (CN) 2023-11-23 US disclosed
US-20230380280-A1 ORGANIC COMPOUNDS, MIXTURES AND APPLICATIONS THEREOF IN ORGANIC ELECTRONIC DEVICES Zhejiang Brilliant Optoelectronic Technology Co.,Ltd. (CN) 2023-11-23 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 (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-20230380280-A1 ORGANIC COMPOUNDS, MIXTURES AND APPLICATIONS THEREOF IN ORGANIC ELECTRONIC DEVICES OR10J3, AOX1, SLCO4C1 IDO1 3549/4885GABRA1 1290/4885GABRG2 1406/4885

“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.