SCHEMBL31663589

SCHEMBL31663589

N#Cc1cccc(-c2cc(-c3ccccc3)nc(-c3ccccc3)c2)c1

nearest known ligand 0.67

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
GABRG2 P18507 6/20 0.67
GABRB3 P28472 6/20 0.67
GABRA5 P31644 6/20 0.67
GABRA3 P34903 6/20 0.67
GABRA1 P14867 2/20 0.67
ALDH1A3 P47895 1/20 0.58
MYC P01106 1/20 0.55
ADORA2A P29274 3/20 0.53
ADORA1 P30542 3/20 0.53
CLK4 Q9HAZ1 1/20 0.51
XDH P47989 1/20 0.50
ADORA2B P29275 2/20 0.49
CTSS P25774 1/20 0.49
CTSK P43235 1/20 0.49
IDO1 P14902 1/20 0.49

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
SCHEMBL31273466 1.00 GABRG2 (0.67) GABRG2GABRB3GABRA5GABRA3GABRA1
SCHEMBL31273727 0.98 GABRG2 (0.65) GABRG2GABRB3GABRA5GABRA3GABRA1
SCHEMBL20395967 0.91 MYC (0.57) GABRG2GABRB3GABRA5GABRA3GABRA1
SCHEMBL23383673 0.88 GABRG2 (0.55) GABRG2GABRB3GABRA5GABRA3GABRA1
SCHEMBL22986972 0.88 GABRG2 (0.55) GABRG2GABRB3GABRA5GABRA3GABRA1
SCHEMBL22987006 0.88 GABRG2 (0.55) GABRG2GABRB3GABRA5GABRA3GABRA1
SCHEMBL23383839 0.88 GABRG2 (0.55) GABRG2GABRB3GABRA5GABRA3GABRA1
SCHEMBL23384027 0.88 MYC (0.54) GABRG2GABRB3GABRA5GABRA3GABRA1
SCHEMBL10431256 0.87 GABRA1 (0.59) GABRG2GABRB3GABRA5GABRA3GABRA1
SCHEMBL23383824 0.87 GABRG2 (0.53) GABRG2GABRB3GABRA5GABRA3GABRA1

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-20250359476-A1 COMPOSITION OF MATTER FOR USE IN ORGANIC LIGHT-EMITTING DIODES KYULUX INC (JP) 2025-11-20 US disclosed
US-12369492-B2 Composition of matter for use in organic light-emitting diodes KYULUX, INC. (JP) 2025-07-22 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 (2 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-20250359476-A1 COMPOSITION OF MATTER FOR USE IN ORGANIC LIGHT-EMITTING DIODES CRY2, SLCO1B3, NDUFV3 GABRG2 3351/4885GABRB3 2361/4885GABRA5 2984/4885
US-12369492-B2 Composition of matter for use in organic light-emitting diodes CRY2, SLCO1B3, NDUFV3 GABRG2 3351/4885GABRB3 2361/4885GABRA5 2984/4885

“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.