SCHEMBL21131402

SCHEMBL21131402

N#Cc1ccc(-c2ccc3c4ccc(-c5ccc(C#N)cc5C#N)cc4n(-c4ccc(C#N)c(-c5cc(-n6c7cc(-c8ccc(C#N)cc8C#N)ccc7c7ccc(-c8ccc(C#N)cc8C#N)cc76)ccc5C#N)c4)c3c2)c(C#N)c1

nearest known ligand 0.40

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
STS P08842 1/20 0.40
ALDH1A1 P00352 1/20 0.35
LMNA P02545 1/20 0.35
HPGD P15428 1/20 0.35
MAPK1 P28482 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
PRMT5 O14744 1/20 0.35
WDR77 Q9BQA1 1/20 0.35
ALK Q9UM73 1/20 0.33
NR3C1 P04150 1/20 0.33
TDP2 O95551 1/20 0.31
FLT3 P36888 3/20 0.31
TRPA1 O75762 1/20 0.31
USP14 P54578 1/20 0.31

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
SCHEMBL21132052 0.94 STS (0.39) STSALDH1A1LMNAHPGDMAPK1
SCHEMBL20923039 0.90 FLT3 (0.40) STSALDH1A1LMNAHPGDMAPK1
SCHEMBL21131404 0.90 STS (0.40) STSALDH1A1LMNAHPGDMAPK1
SCHEMBL21131603 0.88 PGR (0.38) ALDH1A1LMNAHPGDMAPK1SMN1; SMN2
SCHEMBL21132057 0.87 TDP2 (0.37) ALDH1A1LMNAHPGDMAPK1SMN1; SMN2
SCHEMBL20156114 0.87 ALDH1A1 (0.34) STSALDH1A1LMNAHPGDMAPK1
SCHEMBL21131403 0.87 STS (0.39) STSALDH1A1LMNAHPGDMAPK1
SCHEMBL21131415 0.86 AR (0.40) STSPRMT5WDR77
SCHEMBL21116470 0.85 STS (0.41) STSPRMT5WDR77FLT3
SCHEMBL21131773 0.85 NR3C1 (0.45) ALDH1A1LMNAHPGDMAPK1SMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11380849-B2 Organic molecules for use in optoelectronic devices CYNORA GMBH (DE) 2022-07-05 US disclosed
EP-3478657-B1 DICARBAZOLBIPHENYLDERIVATIVES FOR USE IN OPTOELECTRONIC DEVICES CYNORA GMBH (DE) 2021-04-21 EP disclosed
US-20190198778-A1 ORGANIC MOLECULES FOR USE IN OPTOELECTRONIC DEVICES CYNORA GMBH (DE) 2019-06-27 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 (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-11380849-B2 Organic molecules for use in optoelectronic devices OR10J3, NOX3, ORC3 STS 2004/4885ALDH1A1 2468/4885LMNA 3331/4885
US-20190198778-A1 ORGANIC MOLECULES FOR USE IN OPTOELECTRONIC DEVICES ORC3, OR10J3, NOX3 STS 2085/4885ALDH1A1 2353/4885LMNA 3142/4885

“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.