SCHEMBL13299534

SCHEMBL13299534

Cc1ccc2c(c1)nc(-c1ccccc1)n2CC(C)(C)C

nearest known ligand 0.72

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NLRP3 Q96P20 1/20 0.72
TP53 P04637 4/20 0.51
MAPT P10636 1/20 0.51
HPGD P15428 1/20 0.48
JAK2 O60674 3/20 0.47
JAK1 P23458 3/20 0.47
TYK2 P29597 3/20 0.47
JAK3 P52333 3/20 0.47
KDM4E B2RXH2 5/20 0.47
HSD17B10 Q99714 3/20 0.47
GRM2 Q14416 3/20 0.46
ALDH1A1 P00352 2/20 0.46
PDE6D O43924 1/20 0.46
ALDH2 P05091 1/20 0.46
ALDH3A1 P30838 1/20 0.46
LMNA P02545 1/20 0.45
TSHR P16473 1/20 0.45
NPSR1 Q6W5P4 1/20 0.44
TLR7 Q9NYK1 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.43

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
SCHEMBL2464947 0.85 HPGD (0.64) TP53MAPTHPGDKDM4EHSD17B10
SCHEMBL10030013 0.84 NLRP3 (1.00) NLRP3TP53MAPTHPGDJAK2
SCHEMBL8233038 0.81 NLRP3 (0.74) NLRP3TP53MAPTHPGDKDM4E
SCHEMBL13299519 0.80 NLRP3 (0.72) NLRP3TP53MAPTHPGDJAK2
SCHEMBL16509309 0.80 NLRP3 (0.67) NLRP3TP53MAPTHPGDJAK2
SCHEMBL16509253 0.80 NLRP3 (0.67) NLRP3TP53MAPTHPGDJAK2
SCHEMBL28935901 0.78 NLRP3 (0.60) NLRP3TP53MAPTHPGDKDM4E
SCHEMBL1104834 0.75 NLRP3 (0.65) NLRP3TP53MAPTHPGDKDM4E
SCHEMBL13299543 0.74 NLRP3 (0.52) NLRP3TP53MAPTKDM4EALDH1A1
SCHEMBL13299542 0.74 NLRP3 (0.52) NLRP3TP53MAPTKDM4EALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8367223-B2 Heteroleptic phosphorescent emitters UNIVERSAL DISPLAY CORPORATION (US) 2013-02-05 US disclosed
US-8367223-B2 Heteroleptic phosphorescent emitters UNIVERSAL DISPLAY CORPORATION (US) 2013-02-05 US disclosed
US-20100141127-A1 PHOSPHORESCENT EMITTERS UNIVERSAL DISPLAY CORPORATION (US) 2010-06-10 US disclosed
US-20100141127-A1 PHOSPHORESCENT EMITTERS UNIVERSAL DISPLAY CORPORATION (US) 2010-06-10 US disclosed
WO-2010056669-A1 PHOSPHORESCENT EMITTERS UNIVERSAL DISPLAY CORPORATION (US) 2010-05-20 WO 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-20100141127-A1 PHOSPHORESCENT EMITTERS PAICS, TYMP, NUDT1 NLRP3 651/4885TP53 2898/4885MAPT 106/4885

“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.