SCHEMBL21546878

SCHEMBL21546878

Cc1ccc2c3ccc(C)cc3n(-c3cc(C(F)(F)F)cc(-n4c5cc(C)ccc5c5ccc(C)cc54)c3-c3cccc(C#N)c3)c2c1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAT2A P31153 1/20 0.42
GRM5 P41594 2/20 0.38
TRPA1 O75762 1/20 0.37
PTGDR2 Q9Y5Y4 1/20 0.36
PTPN5 P54829 1/20 0.36
CNR2 P34972 1/20 0.36
AR P10275 1/20 0.36
SYK P43405 1/20 0.35
HCRTR1 O43613 1/20 0.34
HCRTR2 O43614 1/20 0.34
GRIN1 Q05586 2/20 0.34
GRIN2B Q13224 2/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
GABRP O00591 1/20 0.34
GABRD O14764 1/20 0.34
GABRA1 P14867 1/20 0.34
GABRB1 P18505 1/20 0.34
GABRG2 P18507 1/20 0.34
GABRB3 P28472 1/20 0.34
GABRA5 P31644 1/20 0.34

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
SCHEMBL22760734 0.96 MAT2A (0.40) MAT2AGRM5TRPA1PTGDR2PTPN5
SCHEMBL22761033 0.92 AR (0.44) MAT2AGRM5TRPA1PTGDR2PTPN5
SCHEMBL21547101 0.92 PTPN5 (0.41) MAT2AGRM5TRPA1PTGDR2PTPN5
SCHEMBL22760728 0.92 MAT2A (0.43) MAT2AGRM5TRPA1PTGDR2PTPN5
SCHEMBL21547026 0.91 MAT2A (0.43) MAT2AGRM5TRPA1PTGDR2PTPN5
SCHEMBL22760735 0.90 MAT2A (0.41) MAT2AGRM5TRPA1PTGDR2PTPN5
SCHEMBL21546711 0.90 MAT2A (0.38) MAT2AGRM5TRPA1PTGDR2PTPN5
SCHEMBL21547129 0.90 PTPN5 (0.43) MAT2AGRM5TRPA1PTGDR2PTPN5
SCHEMBL21546884 0.90 MAT2A (0.47) MAT2AGRM5TRPA1PTGDR2PTPN5
SCHEMBL21546846 0.89 MAT2A (0.42) MAT2AGRM5TRPA1PTGDR2PTPN5

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10981930-B2 Organic molecules for use in optoelectronic devices CYNORA GMBH (DE) 2021-04-20 US disclosed
US-20200385399-A1 ORGANIC MOLECULES FOR USE IN OPTOELECTRONIC DEVICES SAMSUNG DISPLAY CO., LTD. (KR) 2020-12-10 US disclosed
EP-3478793-B1 ORGANIC MOLECULES, IN PARTICULAR FOR USE IN OPTOELECTRONIC DEVICES CYNORA GMBH (DE) 2019-11-06 EP 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-10981930-B2 Organic molecules for use in optoelectronic devices OR10J3, OR51E2, EPCAM MAT2A 1149/4885GRM5 3532/4885TRPA1 54/4885
US-20200385399-A1 ORGANIC MOLECULES FOR USE IN OPTOELECTRONIC DEVICES OR10J3, OR51E2, EPCAM MAT2A 1149/4885GRM5 3532/4885TRPA1 54/4885

“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.