SCHEMBL25465256

SCHEMBL25465256

Cc1cnc2c3ccccc3n(-c3cccc[n+]3C)c2c1C

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GABRP O00591 2/20 0.38
GABRD O14764 2/20 0.38
GABRA1 P14867 2/20 0.38
GABRB1 P18505 2/20 0.38
GABRG2 P18507 2/20 0.38
GABRB3 P28472 2/20 0.38
GABRA5 P31644 2/20 0.38
GABRA3 P34903 2/20 0.38
GABRA2 P47869 2/20 0.38
GABRB2 P47870 2/20 0.38
GABRA4 P48169 2/20 0.38
GABRE P78334 2/20 0.38
GABRA6 Q16445 2/20 0.38
GABRG1 Q8N1C3 2/20 0.38
GABRG3 Q99928 2/20 0.38
GABRQ Q9UN88 2/20 0.38
CCR1 P32246 1/20 0.35
CCR5 P51681 1/20 0.35
CCR8 P51685 1/20 0.35
LIMK1 P53667 1/20 0.33

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
SCHEMBL25769792 0.79 ALKBH5 (0.37) LMNA
SCHEMBL25465260 0.75 ALKBH5 (0.50) LMNA
SCHEMBL26445005 0.74 MAOA (0.36) GABRPGABRDGABRA1GABRB1GABRG2
SCHEMBL25564869 0.73 GABRP (0.62) GABRPGABRDGABRA1GABRB1GABRG2
SCHEMBL25465257 0.72 LMNA (0.32) LMNA
SCHEMBL25446706 0.71 HDAC8 (0.34) LMNA
SCHEMBL26303202 0.70 ALKBH5 (0.41) LMNA
SCHEMBL26444889 0.68 ALKBH5 (0.39) LMNA
SCHEMBL25465259 0.68 PDE4A (0.37) LMNA
SCHEMBL26298976 0.66 NQO2 (0.42) LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230146345-A1 ORGANIC ELECTROLUMINESCENT MATERIALS AND DEVICES UNIVERSAL DISPLAY CORPORATION (US) 2023-05-11 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-20230146345-A1 ORGANIC ELECTROLUMINESCENT MATERIALS AND DEVICES LAGE3, ERCC1, DDT GABRP 1719/4885GABRD 3597/4885GABRA1 2688/4885

“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.