SCHEMBL25658554

SCHEMBL25658554

N#Cc1ccc(-c2cc(-n3c4ccccc4c4cc(-c5ccccc5C#N)ccc43)c(C#N)c(-n3c4ccccc4c4cc(-c5ccccc5C#N)ccc43)c2)c(C(F)(F)F)c1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AR P10275 8/20 0.41
PGR P06401 2/20 0.36
NR3C1 P04150 1/20 0.34
PDE3B Q13370 1/20 0.34
PDE3A Q14432 1/20 0.34
GABRA1 P14867 1/20 0.33
GABRG2 P18507 1/20 0.33
GABRB3 P28472 1/20 0.33
GABRA5 P31644 1/20 0.33
GABRA3 P34903 1/20 0.33
PDE10A Q9Y233 1/20 0.33
ALOX5AP P20292 1/20 0.33
FEN1 P39748 1/20 0.33
CYP1A2 P05177 3/20 0.32
CYP3A4 P08684 3/20 0.32
HSD17B10 Q99714 3/20 0.32
MEN1 O00255 2/20 0.32
KMT2A Q03164 2/20 0.32
HPGD P15428 2/20 0.32
KDM4E B2RXH2 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
SCHEMBL25659386 0.95 AR (0.39) ARPGR
SCHEMBL20616799 0.93 AR (0.46) ARPGRNR3C1PDE10AALOX5AP
SCHEMBL22985249 0.92 AR (0.42) ARPGRNR3C1PDE3BPDE3A
SCHEMBL21258833 0.91 AR (0.41) ARPGRNR3C1PDE3BPDE3A
SCHEMBL22985383 0.91 AR (0.41) ARPGRNR3C1PDE3BPDE3A
SCHEMBL19917600 0.91 AR (0.41) ARPGRNR3C1PDE3BPDE3A
SCHEMBL22985260 0.90 AR (0.42) ARPGRNR3C1PDE3BPDE3A
SCHEMBL25659380 0.90 KIF11 (0.40) ARPDE10AMEN1KMT2APTPN5
SCHEMBL25659384 0.90 AR (0.38) ARPGRALOX5APFEN1
SCHEMBL25658539 0.90 AR (0.34) ARPDE10AMEN1KMT2AHPGD

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-11825743-B2 Organic molecules for use in organic optoelectronic devices SAMSUNG DISPLAY CO., LTD. (KR) 2023-11-21 US disclosed
EP-3585777-B1 ORGANIC MOLECULES, ESPECIALLY FOR USE IN ORGANIC OPTOELECTRONIC DEVICES SAMSUNG DISPLAY CO LTD (KR) 2023-05-10 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 (1 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-11825743-B2 Organic molecules for use in organic optoelectronic devices OR10J3, OR51E2, OCIAD2 AR 4630/4885PGR 3250/4885NR3C1 4406/4885

“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.