SCHEMBL17877800

SCHEMBL17877800

N#Cc1ccc2c(c1)c1cc(C#N)ccc1n2-c1ccc2c(c1)-c1cc(-n3c4ccc(C#N)cc4c4cc(C#N)ccc43)ccc1CS(=O)(=O)C2

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
USP14 P54578 3/20 0.37
PTGDR2 Q9Y5Y4 1/20 0.35
LRRK2 Q5S007 2/20 0.33
ALK Q9UM73 2/20 0.33
MIF P14174 1/20 0.32
G6PD P11413 1/20 0.31
TDP2 O95551 1/20 0.31
GABRP O00591 1/20 0.31
GABRD O14764 1/20 0.31
GABRA1 P14867 1/20 0.31
GABRB1 P18505 1/20 0.31
GABRG2 P18507 1/20 0.31
GABRB3 P28472 1/20 0.31
GABRA5 P31644 1/20 0.31
GABRA3 P34903 1/20 0.31
GABRA2 P47869 1/20 0.31
GABRB2 P47870 1/20 0.31
GABRA4 P48169 1/20 0.31
GABRE P78334 1/20 0.31
GABRA6 Q16445 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
SCHEMBL17877796 0.94 PTGDR2 (0.36) USP14PTGDR2G6PD
SCHEMBL17877799 0.94 PTGDR2 (0.36) USP14PTGDR2G6PD
SCHEMBL17877798 0.94 PTGDR2 (0.36) USP14PTGDR2G6PD
SCHEMBL17877859 0.94 PTGDR2 (0.36) USP14PTGDR2G6PD
SCHEMBL17877673 0.90 PTGDR2 (0.34) USP14PTGDR2LRRK2ALKG6PD
SCHEMBL17877678 0.90 PTGDR2 (0.34) USP14PTGDR2LRRK2ALKG6PD
SCHEMBL17877841 0.85 PTGDR2 (0.34) USP14PTGDR2G6PD
SCHEMBL17877790 0.83 PTGDR2 (0.33) PTGDR2
SCHEMBL17876015 0.82 FLT3 (0.38) PTGDR2
SCHEMBL17877794 0.82 TNKS (0.34) PTGDR2

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-10581000-B2 Condensed cyclic compound and organic light-emitting device including the same SAMSUNG ELECTRONICS CO., LTD. (KR) 2020-03-03 US disclosed
US-20160190482-A1 CONDENSED CYCLIC COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE SAME SAMSUNG ELECTRONICS CO., LTD. (KR) 2016-06-30 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-10581000-B2 Condensed cyclic compound and organic light-emitting device including the same CRY1, CRY2, CCNE2 USP14 3083/4885PTGDR2 2045/4885LRRK2 1492/4885
US-20160190482-A1 CONDENSED CYCLIC COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE SAME CRY1, CRY2, CCNE2 USP14 3083/4885PTGDR2 2045/4885LRRK2 1492/4885

“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.