SCHEMBL20849154

SCHEMBL20849154

Cc1ccccc1-c1ccc2c(c1)c1cc(-c3ccccc3C)ccc1n2-c1ccc(-c2ccc(C(F)(F)F)cc2C(F)(F)F)cc1-c1c(C#N)cccc1-n1c2ccc(-c3ccccc3C)cc2c2cc(-c3ccccc3C)ccc21

nearest known ligand 0.47

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
AR P10275 11/20 0.47
EDNRB P24530 1/20 0.35
EDNRA P25101 1/20 0.35
PGR P06401 2/20 0.34
CYP2C9 P11712 1/20 0.34
SCN9A Q15858 1/20 0.34
BCAT1 P54687 1/20 0.33
TSHR P16473 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
PDE3B Q13370 1/20 0.32
PDE3A Q14432 1/20 0.32
XDH P47989 1/20 0.31
ALOX5AP P20292 1/20 0.31
FEN1 P39748 1/20 0.31
BACE1 P56817 1/20 0.31

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
SCHEMBL20849165 0.97 AR (0.45) AREDNRBEDNRAPGRCYP2C9
SCHEMBL22985625 0.93 AR (0.43) ARPGRBCAT1TSHRSMN1; SMN2
SCHEMBL20849519 0.93 AR (0.40) AREDNRBEDNRAPGRCYP2C9
SCHEMBL20849012 0.93 AR (0.38) AREDNRBEDNRAPGRCYP2C9
SCHEMBL22985127 0.91 AR (0.47) ARPGRPDE3BPDE3A
SCHEMBL20849102 0.91 AR (0.48) AREDNRBEDNRAPGRCYP2C9
SCHEMBL20848739 0.91 AR (0.38) AREDNRBEDNRAPGRCYP2C9
SCHEMBL20849159 0.91 AR (0.38) AREDNRBEDNRAPGRCYP2C9
SCHEMBL22985622 0.91 AR (0.41) ARPGRBCAT1TSHRSMN1; SMN2
SCHEMBL21399693 0.90 AR (0.44) ARPGRBCAT1TSHRSMN1; SMN2

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 3706/4885EDNRB 1908/4885EDNRA 2566/4885
US-20190097141-A1 ORGANIC MOLECULES FOR USE IN OPTOELECTRONIC DEVICES OCIAD2, OCIAD1, POU2F1 AR 3706/4885EDNRB 1908/4885EDNRA 2566/4885

“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.