SCHEMBL19909413

SCHEMBL19909413

Cc1cc(C)cc(-c2ccc3c4ccc(-c5cc(C)cc(C)c5)cc4n(-c4cc(C#N)cc(-n5c6cc(-c7cc(C)cc(C)c7)ccc6c6ccc(-c7cc(C)cc(C)c7)cc65)c4-c4cc(C)nc(C)c4)c3c2)c1

nearest known ligand 0.44

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
IRAK4 Q9NWZ3 1/20 0.37
KDM5B Q9UGL1 1/20 0.35
GRM5 P41594 1/20 0.34
CHEK1 O14757 1/20 0.33
METAP2 P50579 1/20 0.33
HSD11B1 P28845 1/20 0.33
PGR P06401 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
SCHEMBL19913286 0.94 IRAK4 (0.34) IRAK4KDM5BGRM5CHEK1METAP2
SCHEMBL19913283 0.93 CHEK1 (0.37) IRAK4CHEK1METAP2HSD11B1
SCHEMBL19909104 0.93 IRAK4 (0.36) IRAK4CHEK1
SCHEMBL19913281 0.91 KDM4A (0.37) IRAK4KDM5B
SCHEMBL19909127 0.90 CHEK1 (0.41) IRAK4CHEK1HSD11B1PGR
SCHEMBL21414253 0.90 GRM5 (0.37) KDM5BGRM5CHEK1PGR
SCHEMBL22563560 0.89 IRAK4 (0.36) IRAK4KDM5BGRM5CHEK1HSD11B1
SCHEMBL19909396 0.89 CHEK1 (0.33) IRAK4CHEK1HSD11B1
SCHEMBL19913273 0.88 ABCG2 (0.36) IRAK4GRM5CHEK1METAP2
SCHEMBL19913267 0.88 ALDH1A1 (0.35) IRAK4GRM5HSD11B1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11588114-B2 Organic molecules for use in optoelectronic devices SAMSUNG DISPLAY CO., LTD. (KR) 2023-02-21 US disclosed
US-20200212316-A1 ORGANIC MOLECULES FOR USE IN OPTOELECTRONIC DEVICES CYNORA GMBH (DE) 2020-07-02 US disclosed
US-10665792-B2 Organic molecules for use in optoelectronic devices CYNORA GMBH (DE) 2020-05-26 US disclosed
US-20180062085-A1 ORGANIC MOLECULES FOR USE IN OPTOELECTRONIC DEVICES SAMSUNG DISPLAY CO., LTD. (KR) 2018-03-01 US disclosed
US-20180062085-A1 ORGANIC MOLECULES FOR USE IN OPTOELECTRONIC DEVICES SAMSUNG DISPLAY CO., LTD. (KR) 2018-03-01 US disclosed
EP-3287451-A1 ORGANIC MOLECULES, IN PARTICULAR FOR USE IN ORGANIC OPTOELECTRONIC DEVICES CYNORA GMBH (DE) 2018-02-28 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 (3 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-20200212316-A1 ORGANIC MOLECULES FOR USE IN OPTOELECTRONIC DEVICES OR10J3, OPRM1, OR51E2 IRAK4 2708/4885KDM5B 4454/4885GRM5 1534/4885
US-10665792-B2 Organic molecules for use in optoelectronic devices OR10J3, CFD, AOX1 IRAK4 2700/4885KDM5B 4185/4885GRM5 4073/4885
US-11588114-B2 Organic molecules for use in optoelectronic devices OR10J3, OPRM1, OR51E2 IRAK4 2708/4885KDM5B 4454/4885GRM5 1534/4885

“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.