SCHEMBL20655558

SCHEMBL20655558

Cc1nc(C)nc(-c2ccc(-n3c4ccc(-c5ccc(C#N)cc5C#N)cc4c4cc(-c5ccc(C#N)cc5C#N)ccc43)c(-c3nc(C)nc(C)n3)c2)n1

nearest known ligand 0.36

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
STS P08842 1/20 0.36
PTGER4 P35408 1/20 0.33
CYP11B1 P15538 1/20 0.32
CYP11B2 P19099 1/20 0.32
PRMT5 O14744 1/20 0.32
WDR77 Q9BQA1 1/20 0.32
CRHR1 P34998 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
SCHEMBL20655460 0.95 PTGER4 (0.40) STSPTGER4PRMT5WDR77CRHR1
SCHEMBL20655457 0.92 STS (0.36) STSCYP11B1CYP11B2PRMT5WDR77
SCHEMBL20648352 0.90 PTGER4 (0.35) PTGER4CYP11B1CYP11B2
SCHEMBL20655459 0.89 STS (0.35) STSPTGER4PRMT5WDR77CRHR1
SCHEMBL20655221 0.88 PIK3CD (0.36) PTGER4CYP11B2
SCHEMBL22985120 0.88 ALOX5AP (0.39)
SCHEMBL20654928 0.88 CYP1A2 (0.36) STS
SCHEMBL20654942 0.87 CYP1A2 (0.42)
SCHEMBL20114589 0.87 STS (0.35) STSPTGER4CYP11B1CYP11B2PRMT5
SCHEMBL20792039 0.86 PTGER4 (0.36) PTGER4CYP11B1CYP11B2

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-11005048-B2 Organic molecules, in particular for use in optoelectronic devices CYNORA GMBH (DE) 2021-05-11 US disclosed
EP-3530659-A1 ORGANIC MOLECULES, IN PARTICULAR FOR USE IN OPTOELECTRONIC DEVICES CYNORA GMBH (DE) 2019-08-28 EP disclosed
US-20190019960-A1 ORGANIC MOLECULES, IN PARTICULAR FOR USE IN OPTOELECTRONIC DEVICES CYNORA GMBH (DE) 2019-01-17 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-20190019960-A1 ORGANIC MOLECULES, IN PARTICULAR FOR USE IN OPTOELECTRONIC DEVICES OR10J3, OR51E2, ORC3 STS 2190/4885PTGER4 585/4885CYP11B1 1100/4885
US-11005048-B2 Organic molecules, in particular for use in optoelectronic devices OR10J3, OR51E2, ORC3 STS 2190/4885PTGER4 585/4885CYP11B1 1100/4885

“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.