SCHEMBL14224770

SCHEMBL14224770

CC(C)(c1cccc(-c2cccc(C#N)c2)n1)c1cccc(-c2cccc(C#N)c2)n1

nearest known ligand 0.54

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
CTSS P25774 2/20 0.48
CTSK P43235 1/20 0.48
IDO1 P14902 2/20 0.48
GRM2 Q14416 1/20 0.46
CLK4 Q9HAZ1 1/20 0.46
XDH P47989 1/20 0.46
GRM5 P41594 2/20 0.43
KDM1A O60341 1/20 0.43
GABRG2 P18507 2/20 0.42
GABRB3 P28472 2/20 0.42
GABRA5 P31644 2/20 0.42
GABRA3 P34903 2/20 0.42
GABRA1 P14867 1/20 0.42
ADORA2A P29274 1/20 0.42
ADORA2B P29275 1/20 0.42
ADORA1 P30542 1/20 0.42
MAOB P27338 1/20 0.42

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
SCHEMBL14224868 0.85 GABRG2 (0.42) CTSSCTSKIDO1GRM2GABRG2
SCHEMBL14224889 0.83 GRM5 (0.57) GRM2GRM5
SCHEMBL3266995 0.79 IDO1 (0.51) CTSSCTSKIDO1CLK4XDH
SCHEMBL10431256 0.78 GABRA1 (0.59) CTSSCTSKIDO1CLK4XDH
SCHEMBL9792980 0.77 CTSS (0.62) CTSSCTSKIDO1CLK4XDH
SCHEMBL15469175 0.77 MEN1 (0.47)
SCHEMBL12836990 0.76 CTSS (0.47) CTSSCTSKIDO1GRM2CLK4
SCHEMBL11931991 0.76 MEN1 (0.60) ADORA2AADORA1
SCHEMBL901316 0.76 ASIC3 (0.56) CTSSCTSKIDO1CLK4XDH
SCHEMBL20710587 0.75 XDH (0.49) CTSSCTSKIDO1CLK4XDH

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8202631-B2 Light-emitting device FUJIFILM CORPORATION (JP) 2012-06-19 US disclosed
US-7732606-B2 Light-emitting device FUJIFILM CORPORATION (JP) 2010-06-08 US disclosed
US-20090309490-A1 LIGHT-EMITTING DEVICE UDC IRELAND LIMITED (IE) 2009-12-17 US disclosed
US-20080079358-A1 Organic electroluminescent element FUJIFILM CORPORATION 2008-04-03 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-20090309490-A1 LIGHT-EMITTING DEVICE L1CAM, LIG1, CD274 CTSS 3526/4885CTSK 4234/4885IDO1 487/4885

“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.