SCHEMBL19843449

SCHEMBL19843449

O=C1c2cccc(-n3c4c(-c5nc(-c6ccccc6)nc(-c6ccccc6)n5)cccc4c4cccc(-c5nc(-c6ccccc6)nc(-c6ccccc6)n5)c43)c2C(=O)N1c1ccc(-c2ccccc2)cc1-c1ccccc1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TYMS P04818 1/20 0.43
▸ PDE6D O43924 1/20 0.40
▸ NR1H2 P55055 1/20 0.40
▸ ALDH1A1 P00352 2/20 0.39
▸ HTT P42858 2/20 0.38
▸ HSD17B10 Q99714 1/20 0.38
▸ POLB P06746 1/20 0.38
▸ MEN1 O00255 4/20 0.34
▸ KMT2A Q03164 4/20 0.34
▸ LMNA P02545 1/20 0.34
▸ HPGD P15428 1/20 0.34
▸ MAPT P10636 1/20 0.34
▸ TLR9 Q9NR96 1/20 0.34
▸ L3MBTL1 Q9Y468 1/20 0.34
▸ PLAUR Q03405 1/20 0.34
▸ MGLL Q99685 1/20 0.33
▸ PDE10A Q9Y233 1/20 0.33
▸ CASP3 P42574 1/20 0.32
▸ HPSE Q9Y251 2/20 0.32
▸ PDCD1 Q15116 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
SCHEMBL19843448 0.95 TYMS (0.41) TYMSPDE6DNR1H2ALDH1A1HTT
SCHEMBL19843604 0.93 TYMS (0.46) TYMSPDE6DNR1H2ALDH1A1HTT
SCHEMBL19842627 0.91 TYMS (0.47) TYMSPDE6DNR1H2ALDH1A1HTT
SCHEMBL19843439 0.91 NR1H2 (0.48) TYMSPDE6DNR1H2ALDH1A1HTT
SCHEMBL19843331 0.91 TYMS (0.45) TYMSPDE6DNR1H2ALDH1A1HTT
SCHEMBL19843586 0.88 PDE6D (0.39) TYMSPDE6DNR1H2ALDH1A1HTT
SCHEMBL19843605 0.88 TYMS (0.43) TYMSPDE6DNR1H2ALDH1A1HTT
SCHEMBL19843338 0.87 TP53 (0.42) TYMSPDE6DALDH1A1HTTPOLB
SCHEMBL23516110 0.87 TYMS (0.39) TYMSPDE6DNR1H2ALDH1A1HTT
SCHEMBL19843495 0.87 POLB (0.41) TYMSPDE6DNR1H2ALDH1A1HTT

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
EP-3494112-B1 ORGANIC MOLECULES FOR USE IN ORGANIC OPTOELECTRONIC DEVICES CYNORA GMBH (DE) 2022-04-20 — — EP disclosed
US-11276825-B2 Organic molecules for use in organic devices CYNORA GMBH (DE) 2022-03-15 — — US disclosed
US-20210184134-A1 ORGANIC MOLECULES FOR USE IN ORGANIC DEVICES SAMSUNG DISPLAY CO., LTD. (KR) 2021-06-17 — — US disclosed
WO-2018024725-A1 ORGANIC MOLECULES FOR USE IN ORGANIC OPTOELECTRONIC DEVICES CYNORA GMBH (DE) 2018-02-08 — — WO disclosed
EP-3279194-A1 ORGANIC MOLECULES FOR USE IN ORGANIC OPTOELECTRONIC DEVICES CYNORA GMBH (DE) 2018-02-07 — — 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-20210184134-A1 ORGANIC MOLECULES FOR USE IN ORGANIC DEVICES CHRM1, C1S, DNMT3L TYMS 2681/4885PDE6D 611/4885NR1H2 270/4885
US-11276825-B2 Organic molecules for use in organic devices AOX1, OR10J3, L1CAM TYMS 1508/4885PDE6D 162/4885NR1H2 595/4885

“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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