SCHEMBL19909199

SCHEMBL19909199

Cc1cc(-c2cc(-n3c4cc(-c5ccc(C#N)cc5)ccc4c4ccc(-c5ccc(C#N)cc5)cc43)c(C#N)c(-n3c4cc(-c5ccc(C#N)cc5)ccc4c4ccc(-c5ccc(C#N)cc5)cc43)c2)cc(C)n1

nearest known ligand 0.41

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
CHEK1 O14757 1/20 0.41
HSD11B1 P28845 1/20 0.36
HRH4 Q9H3N8 2/20 0.36
PIK3CD O00329 1/20 0.36
PIK3CA P42336 1/20 0.36
METAP2 P50579 1/20 0.36
ALDH1A1 P00352 1/20 0.36
TSHR P16473 1/20 0.36
RECQL P46063 1/20 0.36
KMT2A Q03164 1/20 0.36
ESR1 P03372 1/20 0.35
ESR2 Q92731 1/20 0.35
EGLN2 Q96KS0 1/20 0.34
PGR P06401 1/20 0.34
AR P10275 1/20 0.34
IRAK4 Q9NWZ3 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
SCHEMBL19909203 0.94 CHEK1 (0.38) CHEK1HSD11B1HRH4PIK3CDPIK3CA
SCHEMBL19909209 0.93 METAP2 (0.36) CHEK1METAP2IRAK4
SCHEMBL19909222 0.91 AURKA (0.38) CHEK1METAP2ALDH1A1KMT2AESR1
SCHEMBL22170313 0.91 CYP11B2 (0.37) ALDH1A1TSHRRECQL
SCHEMBL22563378 0.90 CHEK1 (0.40) CHEK1HSD11B1HRH4PIK3CDPIK3CA
SCHEMBL19908985 0.90 ALDH1A1 (0.42) METAP2ALDH1A1KMT2A
SCHEMBL19919477 0.89 ADORA2A (0.39) ALDH1A1KMT2AIRAK4
SCHEMBL19913310 0.89 KDM5B (0.42) CHEK1METAP2ALDH1A1RECQLKMT2A
SCHEMBL21279095 0.87 CHEK1 (0.38) CHEK1HSD11B1HRH4PIK3CDPIK3CA
SCHEMBL19909204 0.87 METAP2 (0.33) METAP2ALDH1A1KMT2APGRIRAK4

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 5 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
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 CHEK1 3673/4885HSD11B1 2137/4885HRH4 4290/4885
US-10665792-B2 Organic molecules for use in optoelectronic devices OR10J3, CFD, AOX1 CHEK1 2506/4885HSD11B1 1910/4885HRH4 1603/4885
US-11588114-B2 Organic molecules for use in optoelectronic devices OR10J3, OPRM1, OR51E2 CHEK1 3673/4885HSD11B1 2137/4885HRH4 4290/4885

“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.