SCHEMBL26772491

SCHEMBL26772491

c1cc2ccc3c4ccncc4n4c5ccccc5[nH]c(c1)c2c34

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CDK4 P11802 2/20 0.46
CCND1 P24385 2/20 0.46
GABRA1 P14867 3/20 0.40
GABRG2 P18507 3/20 0.40
GABRB3 P28472 3/20 0.40
GABRA5 P31644 3/20 0.40
GABRA3 P34903 3/20 0.40
GABRA2 P47869 3/20 0.40
KDM4E B2RXH2 3/20 0.40
ALDH1A1 P00352 2/20 0.40
HPGD P15428 2/20 0.40
SMN1; SMN2 Q16637 2/20 0.40
GABRP O00591 2/20 0.40
GABRD O14764 2/20 0.40
GABRB1 P18505 2/20 0.40
GABRB2 P47870 2/20 0.40
GABRA4 P48169 2/20 0.40
GABRE P78334 2/20 0.40
GABRA6 Q16445 2/20 0.40
GABRG1 Q8N1C3 2/20 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
SCHEMBL26772408 0.85 CDC25B (0.42) CDK4CCND1GABRA1GABRG2GABRB3
SCHEMBL26772506 0.84 CDK4 (0.41) CDK4CCND1GABRA1GABRG2GABRB3
SCHEMBL26772487 0.78 IDO1 (0.39) CDK4CCND1GABRA1GABRG2GABRB3
SCHEMBL26772461 0.76 GABRA1 (0.36) CDK4CCND1GABRA1GABRG2GABRB3
SCHEMBL24527816 0.76 TOP2A (0.38) CDK4CCND1KDM4EIDO1MAOA
SCHEMBL26824210 0.73 GABRP (0.38) CDK4CCND1GABRA1GABRG2GABRB3
SCHEMBL24527832 0.73 KDM4E (0.38) CDK4CCND1KDM4EALDH1A1HPGD
SCHEMBL24961630 0.72 GABRP (0.41) CDK4CCND1GABRA1GABRG2GABRB3
SCHEMBL24528536 0.71 MAOA (0.40) GABRA1GABRG2GABRB3GABRA5GABRA3
SCHEMBL24527828 0.70 IDO1 (0.37) CDK4CCND1KDM4EALDH1A1IDO1

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 CDK4 2560/4885CCND1 2171/4885GABRA1 1290/4885

“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.