SCHEMBL20848866

SCHEMBL20848866

N#Cc1ccccc1-c1ccc2c(c1)c1cc(-c3ccccc3C#N)ccc1n2-c1cccc(C#N)c1-c1c(-c2ccc(C(F)(F)F)cc2C(F)(F)F)cccc1-n1c2ccc(-c3ccccc3C#N)cc2c2cc(-c3ccccc3C#N)ccc21

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AR P10275 10/20 0.39
PGR P06401 2/20 0.37
PTPN5 P54829 1/20 0.37
PDE3B Q13370 1/20 0.36
PDE3A Q14432 1/20 0.36
GABRA1 P14867 2/20 0.36
GABRG2 P18507 2/20 0.36
GABRB3 P28472 2/20 0.36
GABRA5 P31644 2/20 0.36
GABRA3 P34903 2/20 0.36
ALOX5AP P20292 2/20 0.35
FEN1 P39748 2/20 0.35
NR3C1 P04150 1/20 0.34
EDNRB P24530 1/20 0.34
EDNRA P25101 1/20 0.34
KDM4E B2RXH2 2/20 0.33
CYP1A2 P05177 2/20 0.33
CYP3A4 P08684 2/20 0.33
HPGD P15428 2/20 0.33
MEN1 O00255 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
SCHEMBL20848502 0.97 AR (0.37) ARPGRPTPN5PDE3BPDE3A
SCHEMBL20849216 0.94 AR (0.40) ARPGRPTPN5PDE3BPDE3A
SCHEMBL20849102 0.93 AR (0.48) ARPGRPDE3BPDE3AALOX5AP
SCHEMBL20848818 0.93 ALOX5AP (0.35) ARPGRPTPN5PDE3BPDE3A
SCHEMBL22985448 0.92 AR (0.39) ARPGRPTPN5PDE3BPDE3A
SCHEMBL22985426 0.92 ALOX5AP (0.40) ARPGRPTPN5GABRA1GABRG2
SCHEMBL22985043 0.92 AR (0.37) ARPGRPDE3BPDE3AALOX5AP
SCHEMBL20848501 0.91 AR (0.35) ARPGRPTPN5PDE3BPDE3A
SCHEMBL20848878 0.91 AR (0.34) ARPGRPTPN5PDE3BPDE3A
SCHEMBL22985447 0.91 AR (0.39) ARPGRPTPN5PDE3BPDE3A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10978646-B2 Organic molecules for use in optoelectronic devices CYNORA GMBH (DE) 2021-04-13 US disclosed
US-20190097141-A1 ORGANIC MOLECULES FOR USE IN OPTOELECTRONIC DEVICES SAMSUNG DISPLAY CO., LTD. (KR) 2019-03-28 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-10978646-B2 Organic molecules for use in optoelectronic devices OCIAD2, OCIAD1, POU2F1 AR 3706/4885PGR 3590/4885PTPN5 4494/4885
US-20190097141-A1 ORGANIC MOLECULES FOR USE IN OPTOELECTRONIC DEVICES OCIAD2, OCIAD1, POU2F1 AR 3706/4885PGR 3590/4885PTPN5 4494/4885

“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.