SCHEMBL20849253

SCHEMBL20849253

Cc1ccccc1-c1ccc2c(c1)c1ccccc1n2-c1cccc(C#N)c1-c1c(-c2cc(C(F)(F)F)cc(C(F)(F)F)c2)cccc1-n1c2ccccc2c2cc(-c3ccccc3C)ccc21

nearest known ligand 0.44

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
AR P10275 6/20 0.44
BCAT1 P54687 1/20 0.33
PGR P06401 2/20 0.32
BACE1 P56817 1/20 0.32
GPBAR1 Q8TDU6 4/20 0.32
ERBB2 P04626 1/20 0.31
TACR1 P25103 2/20 0.31
XDH P47989 1/20 0.31
GABRA1 P14867 1/20 0.31
GABRG2 P18507 1/20 0.31
GABRB3 P28472 1/20 0.31
GABRA5 P31644 1/20 0.31
GABRA3 P34903 1/20 0.31
SSTR2 P30874 1/20 0.30

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
SCHEMBL20849256 0.97 AR (0.47) ARBCAT1PGRBACE1GPBAR1
SCHEMBL20849094 0.93 AR (0.37) ARPGRTACR1XDHGABRA1
SCHEMBL20849616 0.93 GABRA1 (0.36) ARPGRGPBAR1GABRA1GABRG2
SCHEMBL20849089 0.92 AR (0.35) ARBCAT1PGRGPBAR1SSTR2
SCHEMBL20848934 0.92 AR (0.33) ARPGRGPBAR1TACR1GABRA1
SCHEMBL20848932 0.91 AR (0.38) ARPGRGPBAR1TACR1SSTR2
SCHEMBL20848986 0.90 AR (0.42) ARBCAT1PGRBACE1GPBAR1
SCHEMBL20849254 0.90 AR (0.42) ARTACR1XDHGABRA1GABRG2
SCHEMBL20848579 0.90 TACR1 (0.35) ARTACR1GABRA1GABRG2GABRB3
SCHEMBL20849333 0.90 GABRA1 (0.38) ARPGRGPBAR1GABRA1GABRG2

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 3706/4885BCAT1 4033/4885PGR 3590/4885
US-20190097141-A1 ORGANIC MOLECULES FOR USE IN OPTOELECTRONIC DEVICES OCIAD2, OCIAD1, POU2F1 AR 3706/4885BCAT1 4033/4885PGR 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.