SCHEMBL21546922

SCHEMBL21546922

N#Cc1cccc(-c2c(-n3c4ccc(C#N)cc4c4cc(C#N)ccc43)cc(C(F)(F)F)cc2-n2c3ccc(C#N)cc3c3cc(C#N)ccc32)c1

nearest known ligand 0.43

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MAT2A P31153 1/20 0.43
PTPN5 P54829 1/20 0.40
KIF11 P52732 1/20 0.39
TRPA1 O75762 1/20 0.38
PTGDR2 Q9Y5Y4 1/20 0.37
GRIN1 Q05586 2/20 0.37
GRIN2B Q13224 2/20 0.37
L3MBTL1 Q9Y468 1/20 0.37
CLK4 Q9HAZ1 1/20 0.36
GRM5 P41594 1/20 0.36
ENPP1 P22413 1/20 0.36
RXRA P19793 1/20 0.36
RXRG P48443 1/20 0.36
CETP P11597 1/20 0.36
ALPL P05186 1/20 0.35
ALPI P09923 1/20 0.35
PDK2 Q15119 1/20 0.35
SYK P43405 1/20 0.35
CNR2 P34972 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
SCHEMBL21547030 0.95 MAT2A (0.41) MAT2APTPN5KIF11TRPA1PTGDR2
SCHEMBL21546516 0.94 PTPN5 (0.44) MAT2APTPN5KIF11TRPA1PTGDR2
SCHEMBL21546883 0.94 MAT2A (0.45) MAT2APTPN5KIF11TRPA1PTGDR2
SCHEMBL21547106 0.93 KIF11 (0.44) MAT2APTPN5KIF11TRPA1PTGDR2
SCHEMBL21547026 0.91 MAT2A (0.43) MAT2APTPN5KIF11TRPA1PTGDR2
SCHEMBL21546891 0.90 PTPN5 (0.42) MAT2APTPN5KIF11TRPA1PTGDR2
SCHEMBL21547070 0.90 PTPN5 (0.42) MAT2APTPN5KIF11TRPA1PTGDR2
SCHEMBL22760728 0.90 MAT2A (0.43) MAT2APTPN5KIF11TRPA1PTGDR2
SCHEMBL22760832 0.90 MAT2A (0.43) MAT2APTPN5KIF11TRPA1PTGDR2
SCHEMBL21547090 0.90 PTPN5 (0.47) MAT2APTPN5KIF11TRPA1PTGDR2

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 1149/4885PTPN5 4550/4885KIF11 2801/4885
US-20200385399-A1 ORGANIC MOLECULES FOR USE IN OPTOELECTRONIC DEVICES OR10J3, OR51E2, EPCAM MAT2A 1149/4885PTPN5 4550/4885KIF11 2801/4885

“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.