SCHEMBL21546667

SCHEMBL21546667

Cc1ccc(-c2ccc3c4ccc(-c5ccc(C)cc5)cc4n(-c4cc(C#N)c(-c5cccc(C#N)c5)cc4-n4c5cc(-c6ccc(C)cc6)ccc5c5ccc(-c6ccc(C)cc6)cc54)c3c2)cc1

nearest known ligand 0.41

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
PGR P06401 3/20 0.37
ALDH1A3 P47895 1/20 0.37
AR P10275 2/20 0.37
HRH3 Q9Y5N1 1/20 0.36
MCHR1 Q99705 1/20 0.36
BRD4 O60885 1/20 0.35
CLK4 Q9HAZ1 2/20 0.35
DYRK1A Q13627 1/20 0.35
MAOA P21397 1/20 0.35
MAOB P27338 1/20 0.35
ALDH1A1 P00352 1/20 0.34
CYP1A2 P05177 1/20 0.34
CYP3A4 P08684 1/20 0.34
F11 P03951 1/20 0.34
PIN1 Q13526 1/20 0.34
IRAK4 Q9NWZ3 1/20 0.34
CHEK1 O14757 1/20 0.34

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
SCHEMBL21546677 0.96 ALDH1A3 (0.37) PGRALDH1A3ARHRH3MCHR1
SCHEMBL21546662 0.93 AR (0.41) PGRALDH1A3ARBRD4CLK4
SCHEMBL22760967 0.93 ALDH1A3 (0.39) PGRALDH1A3ARBRD4CLK4
SCHEMBL22761047 0.92 MCHR1 (0.37) PGRALDH1A3ARHRH3MCHR1
SCHEMBL21546855 0.92 ELANE (0.38) ALDH1A3BRD4CLK4DYRK1AALDH1A1
SCHEMBL21546689 0.92 ALDH1A3 (0.42) PGRALDH1A3CLK4ALDH1A1CYP1A2
SCHEMBL22761151 0.92 PGR (0.37) PGRALDH1A3BRD4CLK4IRAK4
SCHEMBL22760791 0.91 PGR (0.37) PGRALDH1A3ARHRH3MCHR1
SCHEMBL22822480 0.90 ALDH1A3 (0.37) PGRALDH1A3ARCLK4ALDH1A1
SCHEMBL21546941 0.90 ALDH1A3 (0.37) PGRALDH1A3BRD4CLK4ALDH1A1

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-10981930-B2 Organic molecules for use in optoelectronic devices CYNORA GMBH (DE) 2021-04-20 US disclosed
US-20200385399-A1 ORGANIC MOLECULES FOR USE IN OPTOELECTRONIC DEVICES SAMSUNG DISPLAY CO., LTD. (KR) 2020-12-10 US disclosed
EP-3478793-B1 ORGANIC MOLECULES, IN PARTICULAR FOR USE IN OPTOELECTRONIC DEVICES CYNORA GMBH (DE) 2019-11-06 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-10981930-B2 Organic molecules for use in optoelectronic devices OR10J3, OR51E2, EPCAM PGR 3398/4885ALDH1A3 39/4885AR 4523/4885
US-20200385399-A1 ORGANIC MOLECULES FOR USE IN OPTOELECTRONIC DEVICES OR10J3, OR51E2, EPCAM PGR 3398/4885ALDH1A3 39/4885AR 4523/4885

“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.