SCHEMBL26635477

SCHEMBL26635477

CC(C)Cc1cc(C#N)cc(C#N)c1

nearest known ligand 0.40

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
GLA P06280 1/20 0.40
TTR P02766 2/20 0.37
ALB P02768 2/20 0.37
CYP2A6 P11509 1/20 0.37
GABRA1 P14867 1/20 0.35
GABRB2 P47870 1/20 0.35
LOXL2 Q9Y4K0 2/20 0.34
SLC6A2 P23975 2/20 0.34
SLC6A4 P31645 2/20 0.34
SLC6A3 Q01959 1/20 0.34
CTSS P25774 1/20 0.34
CTSK P43235 1/20 0.34
ALOX5AP P20292 2/20 0.33
MEN1 O00255 1/20 0.32
KMT2A Q03164 1/20 0.32
ALDH1A1 P00352 1/20 0.31
MAPT P10636 1/20 0.31
HRH3 Q9Y5N1 1/20 0.31

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
SCHEMBL30892597 0.95 GLA (0.40) GLATTRALBCYP2A6GABRA1
SCHEMBL16954001 0.90 GLA (0.35) GLATTRALBCYP2A6GABRA1
SCHEMBL16955860 0.88 GLA (0.36) GLATTRALBCYP2A6GABRA1
SCHEMBL23159233 0.86 ADRA1D (0.38) GLAALOX5AP
SCHEMBL9927072 0.86 GRM5 (0.36) GLA
SCHEMBL16952652 0.86 ALB (0.35) GLATTRALBCYP2A6GABRA1
SCHEMBL16955858 0.86 GLA (0.35) GLATTRALBCYP2A6GABRA1
SCHEMBL16952552 0.83 GLA (0.33) GLATTRALBGABRA1GABRB2
SCHEMBL16952553 0.83 GLA (0.33) GLAALOX5AP
SCHEMBL23898438 0.83 GLA (0.38) GLATTRALBCYP2A6LOXL2

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-20230345811-A1 ORGANIC ELECTROLUMINESCENT MATERIALS AND DEVICES UNIVERSAL DISPLAY CORPORATION (US) 2023-10-26 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-20230345811-A1 ORGANIC ELECTROLUMINESCENT MATERIALS AND DEVICES OPRD1, L1CAM, OPRM1 GLA 2041/4885TTR 1193/4885ALB 2156/4885

“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.