SCHEMBL21156637

SCHEMBL21156637

Cn1c2c(-c3cccc(-c4nc(-c5cc(-c6ccccc6)cc(-c6ccccc6)c5)nc(-c5cc(-c6ccccc6)cc(-c6ccccc6)c5)n4)c3)cccc2c2cccc(-c3cccc(-c4nc(-c5cc(-c6ccccc6)cc(-c6ccccc6)c5)nc(-c5cc(-c6ccccc6)cc(-c6ccccc6)c5)n4)c3)c21

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CYP1A2 P05177 5/20 0.36
▸ CYP3A4 P08684 5/20 0.36
▸ NR1I3 Q14994 4/20 0.36
▸ CYP2C9 P11712 3/20 0.36
▸ CYP2B6 P20813 2/20 0.36
▸ AHR P35869 2/20 0.36
▸ VDR P11473 1/20 0.36
▸ L3MBTL1 Q9Y468 2/20 0.36
▸ CYP2D6 P10635 4/20 0.35
▸ TSHR P16473 3/20 0.35
▸ MAPK1 P28482 3/20 0.35
▸ USP2 O75604 2/20 0.35
▸ CLK4 Q9HAZ1 2/20 0.35
▸ ADORA2A P29274 1/20 0.35
▸ HSD17B10 Q99714 3/20 0.35
▸ KDM4E B2RXH2 1/20 0.34
▸ ALDH1A1 P00352 1/20 0.34
▸ TP53 P04637 1/20 0.34
▸ MAPT P10636 1/20 0.34
▸ HPGD P15428 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
SCHEMBL21157189 0.99 L3MBTL1 (0.39) CYP1A2CYP3A4NR1I3CYP2C9CYP2B6
SCHEMBL21157088 0.94 L3MBTL1 (0.42) CYP1A2CYP3A4NR1I3CYP2C9CYP2B6
SCHEMBL21156639 0.93 L3MBTL1 (0.39) L3MBTL1TSHRMAPK1ADORA2AHSD17B10
SCHEMBL21157190 0.93 L3MBTL1 (0.39) L3MBTL1TSHRMAPK1ADORA2AHSD17B10
SCHEMBL21157188 0.90 L3MBTL1 (0.35) CYP1A2CYP3A4NR1I3CYP2C9CYP2B6
SCHEMBL21157926 0.88 HSD17B10 (0.40) HSD17B10HPGD
SCHEMBL21157911 0.85 MEN1 (0.37) L3MBTL1TSHRMAPK1HSD17B10KDM4E
SCHEMBL21157928 0.84 L3MBTL1 (0.44) L3MBTL1TSHRMAPK1ADORA2AHSD17B10
SCHEMBL21156638 0.84 HSD17B10 (0.44) L3MBTL1CLK4HSD17B10KDM4EMAPT
SCHEMBL21157076 0.84 ABCG2 (0.37) L3MBTL1TSHRMAPK1HSD17B10KDM4E

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-20190214577-A1 THERMALLY ACTIVATED DELAYED FLUORESCENCE MATERIAL, POLYMER, MIXTURE, FORMULATION, AND ORGANIC ELECTRONIC DEVICE GUANGZHOU CHINARAY OPTOELECTRONIC MATERIALS LTD. (CN) 2019-07-11 — — 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-20190214577-A1 THERMALLY ACTIVATED DELAYED FLUORESCENCE MATERIAL, POLYMER, MIXTURE, FORMULATION, AND ORGANIC ELECTRONIC DEVICE TEAD2, TEAD3, TEAD1 CYP1A2 2376/4885CYP3A4 979/4885NR1I3 4568/4885

“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.

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