SCHEMBL21706996

SCHEMBL21706996

Fc1ccc(-n2c3ccccc3c3c4cc(-c5ccc(N(c6ccccc6)c6ccc(-c7ccccc7)cc6)cc5)ccc4n(-c4ccc(F)cc4)c32)cc1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NR3C1 P04150 1/20 0.40
TSPO P30536 1/20 0.37
JAK2 O60674 1/20 0.36
JAK3 P52333 1/20 0.36
METTL3 Q86U44 2/20 0.35
METTL14 Q9HCE5 2/20 0.35
CETP P11597 1/20 0.33
FLT3 P36888 1/20 0.33
KDM4E B2RXH2 1/20 0.33
ATM Q13315 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
PIK3CA P42336 2/20 0.32
MTOR P42345 2/20 0.32
NPSR1 Q6W5P4 1/20 0.32
RXFP1 Q9HBX9 1/20 0.32
ICMT O60725 1/20 0.32
PIK3CD O00329 1/20 0.32
MAPK14 Q16539 1/20 0.32
GRIA1 P42261 1/20 0.32
CACNG8 Q8WXS5 1/20 0.32

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
SCHEMBL21706856 0.95 NR3C1 (0.38) NR3C1TSPOJAK2JAK3CETP
SCHEMBL21706816 0.93 NR3C1 (0.38) NR3C1JAK2JAK3CETPKDM4E
SCHEMBL21706814 0.92 TSPO (0.40) TSPOJAK2JAK3KDM4EATM
SCHEMBL21699152 0.92 TSPO (0.40) TSPOJAK2JAK3KDM4EATM
SCHEMBL21699157 0.92 TSPO (0.40) TSPOJAK2JAK3KDM4EATM
SCHEMBL21706815 0.91 NR3C1 (0.35) NR3C1JAK2JAK3KDM4EATM
SCHEMBL21699372 0.90 L3MBTL1 (0.41) TSPOJAK2JAK3KDM4EATM
SCHEMBL21706831 0.90 L3MBTL1 (0.41) TSPOJAK2JAK3KDM4EATM
SCHEMBL21706857 0.87 KDM4E (0.40) TSPOJAK2JAK3KDM4EATM
SCHEMBL17720431 0.86 NR3C1 (0.41) NR3C1TSPOJAK2JAK3METTL3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20200052223-A1 CONDENSED CYCLIC COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE SAME SAMSUNG DISPLAY CO., LTD. (KR) 2020-02-13 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-20200052223-A1 CONDENSED CYCLIC COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE SAME CRY1, CRY2, CCNE2 NR3C1 714/4885TSPO 3886/4885JAK2 3453/4885

“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.