SCHEMBL20648352

SCHEMBL20648352

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

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTGER4 P35408 1/20 0.35
CYP11B2 P19099 3/20 0.34
CYP11B1 P15538 1/20 0.34
MAPT P10636 1/20 0.33
SETDB1 Q15047 1/20 0.33
CASP3 P42574 1/20 0.32
SCARB1 Q8WTV0 1/20 0.32
CYP1A2 P05177 3/20 0.32
CYP3A4 P08684 3/20 0.32
HRH4 Q9H3N8 2/20 0.32
MEN1 O00255 2/20 0.32
ALDH1A1 P00352 2/20 0.32
CYP2C19 P33261 2/20 0.32
KMT2A Q03164 2/20 0.32
CLK4 Q9HAZ1 2/20 0.32
CYP2D6 P10635 2/20 0.32
TSHR P16473 2/20 0.32
MAPK1 P28482 1/20 0.32
LMNA P02545 1/20 0.32
CYP2C9 P11712 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
SCHEMBL20648361 0.94 PTGER4 (0.42) PTGER4MAPTCYP1A2CYP3A4HRH4
SCHEMBL20655221 0.93 PIK3CD (0.36) PTGER4CYP11B2MAPTHRH4EGLN2
SCHEMBL20648358 0.90 CYP11B2 (0.34) PTGER4CYP11B2CYP11B1SETDB1CASP3
SCHEMBL20655558 0.90 STS (0.36) PTGER4CYP11B2CYP11B1
SCHEMBL20655478 0.90 CYP1A2 (0.40) MAPTCYP1A2CYP3A4HRH4MEN1
SCHEMBL20648263 0.90 PTGER4 (0.32) PTGER4HRH4
SCHEMBL20114579 0.89 L3MBTL1 (0.40) PTGER4MAPTCYP1A2CYP3A4HRH4
SCHEMBL20792039 0.88 PTGER4 (0.36) PTGER4CYP11B2CYP11B1MAPTSETDB1
SCHEMBL20655561 0.88 PTGER4 (0.43) PTGER4MAPTMEN1ALDH1A1KMT2A
SCHEMBL20150412 0.88 CASP3 (0.35) PTGER4CYP11B2CYP11B1SETDB1CASP3

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-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
EP-3431473-A1 ORGANIC MOLECULES, IN PARTICULAR FOR USE IN OPTOELECTRONIC DEVICES CYNORA GMBH (DE) 2019-01-23 EP disclosed
US-20190019960-A1 ORGANIC MOLECULES, IN PARTICULAR FOR USE IN OPTOELECTRONIC DEVICES CYNORA GMBH (DE) 2019-01-17 US disclosed
EP-3428164-A1 ORGANIC MOLECULES, IN PARTICULAR FOR USE IN OPTOELECTRONIC DEVICES CYNORA GMBH (DE) 2019-01-16 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-20190019960-A1 ORGANIC MOLECULES, IN PARTICULAR FOR USE IN OPTOELECTRONIC DEVICES OR10J3, OR51E2, ORC3 PTGER4 585/4885CYP11B2 830/4885CYP11B1 1100/4885
US-11005048-B2 Organic molecules, in particular for use in optoelectronic devices OR10J3, OR51E2, ORC3 PTGER4 585/4885CYP11B2 830/4885CYP11B1 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.