SCHEMBL20848574

SCHEMBL20848574

N#Cc1ccccc1-c1ccc2c(c1)c1cc(-c3ccccc3C#N)ccc1n2-c1ccc(C#N)c(-c2cc(-c3cc(C(F)(F)F)cc(C(F)(F)F)c3)ccc2-n2c3ccc(-c4ccccc4C#N)cc3c3cc(-c4ccccc4C#N)ccc32)c1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NR3C1 P04150 1/20 0.39
AR P10275 7/20 0.37
PGR P06401 2/20 0.35
PTPN5 P54829 1/20 0.35
GABRA1 P14867 2/20 0.33
GABRG2 P18507 2/20 0.33
GABRB3 P28472 2/20 0.33
GABRA5 P31644 2/20 0.33
GABRA3 P34903 2/20 0.33
CYP11B1 P15538 1/20 0.33
CYP11B2 P19099 1/20 0.33
ALDH1A1 P00352 2/20 0.32
CYP1A2 P05177 2/20 0.32
CYP3A4 P08684 2/20 0.32
HSD17B10 Q99714 2/20 0.32
MAPK1 P28482 1/20 0.32
CLK4 Q9HAZ1 1/20 0.32
HPGD P15428 1/20 0.32
ICMT O60725 1/20 0.32
GPBAR1 Q8TDU6 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
SCHEMBL20848576 0.97 NR3C1 (0.37) NR3C1ARPGRPTPN5GABRA1
SCHEMBL21929301 0.94 NR3C1 (0.37) NR3C1ARPGRPTPN5GABRA1
SCHEMBL20849337 0.94 CYP11B1 (0.36) ARCYP11B1CYP11B2ICMT
SCHEMBL20849026 0.93 AR (0.35) NR3C1ARPGRCYP11B1CYP11B2
SCHEMBL20849053 0.93 AR (0.35) ARCYP11B1CYP11B2ALDH1A1MAPK1
SCHEMBL20849350 0.93 AR (0.47) NR3C1ARPGRGPBAR1
SCHEMBL22985190 0.91 ALOX5AP (0.39) NR3C1ARCYP11B1CYP11B2ICMT
SCHEMBL20848537 0.91 AR (0.35) NR3C1ARPGRCYP11B1CYP11B2
SCHEMBL20848532 0.91 AR (0.35) NR3C1ARPGRCYP11B1CYP11B2
SCHEMBL22985194 0.91 ALOX5AP (0.36) NR3C1ARPGRPTPN5CYP11B1

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 NR3C1 4771/4885AR 3706/4885PGR 3590/4885
US-20190097141-A1 ORGANIC MOLECULES FOR USE IN OPTOELECTRONIC DEVICES OCIAD2, OCIAD1, POU2F1 NR3C1 4771/4885AR 3706/4885PGR 3590/4885

“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.