SCHEMBL19843463

SCHEMBL19843463

Cc1nc(C)nc(-c2ccc3c4ccc(-c5nc(C)nc(C)n5)cc4n(-c4cccc5c4C(=O)N(c4cc(-c6ccccc6)ccc4-c4ccccc4)C5=O)c3c2)n1

nearest known ligand 0.47

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ TYMS P04818 1/20 0.47
▸ ALDH1A1 P00352 2/20 0.39
▸ NR1H2 P55055 1/20 0.37
▸ PDCD1 Q15116 9/20 0.36
▸ CD274 Q9NZQ7 9/20 0.36
▸ PDE6D O43924 1/20 0.35
▸ HTT P42858 1/20 0.35
▸ HSD17B10 Q99714 1/20 0.35
▸ HPSE Q9Y251 2/20 0.34
▸ LMNA P02545 1/20 0.33
▸ MEN1 O00255 1/20 0.33
▸ KMT2A Q03164 1/20 0.33

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
SCHEMBL19843475 0.97 TYMS (0.45) TYMSALDH1A1NR1H2PDCD1CD274
SCHEMBL23476539 0.95 TYMS (0.44) TYMSALDH1A1NR1H2PDCD1CD274
SCHEMBL19842959 0.92 TYMS (0.42) TYMSALDH1A1NR1H2PDCD1CD274
SCHEMBL19843465 0.92 TYMS (0.47) TYMSALDH1A1NR1H2PDCD1CD274
SCHEMBL19843608 0.92 TYMS (0.45) TYMSALDH1A1NR1H2PDCD1CD274
SCHEMBL19843464 0.92 TYMS (0.45) TYMSALDH1A1NR1H2PDCD1CD274
SCHEMBL23476492 0.91 TYMS (0.41) TYMSALDH1A1NR1H2PDCD1CD274
SCHEMBL19843330 0.91 TYMS (0.42) TYMSALDH1A1NR1H2PDCD1CD274
SCHEMBL19842696 0.90 TYMS (0.42) TYMSALDH1A1PDE6DHTTHPSE
SCHEMBL19843554 0.90 PDE6D (0.44) TYMSALDH1A1PDE6DHTTLMNA

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 4 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-20210171501-A1 ORGANIC MOLECULES FOR USE IN ORGANIC OPTOELECTRONIC DEVICES SAMSUNG DISPLAY CO., LTD. (KR) 2021-06-10 — — 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 (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-20210171501-A1 ORGANIC MOLECULES FOR USE IN ORGANIC OPTOELECTRONIC DEVICES L1CAM, OR10J3, AOX1 TYMS 2154/4885ALDH1A1 20/4885NR1H2 2382/4885

“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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