SCHEMBL20848768

SCHEMBL20848768

N#Cc1ccc(-c2cc(-c3ccc(C(F)(F)F)cc3C(F)(F)F)ccc2-n2c3ccccc3c3cc(-n4c5ccccc5c5ccccc54)ccc32)c(-n2c3ccccc3c3cc(-n4c5ccccc5c5ccccc54)ccc32)c1

nearest known ligand 0.35

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
EDNRB P24530 1/20 0.33
EDNRA P25101 1/20 0.33
AR P10275 3/20 0.33
KIF11 P52732 2/20 0.33
CYP2C9 P11712 1/20 0.32
SCN9A Q15858 1/20 0.32
ALOX5AP P20292 1/20 0.32
FEN1 P39748 1/20 0.32
PDPK1 O15530 1/20 0.32
ELANE P08246 2/20 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
SCHEMBL20848763 1.00 EDNRB (0.33) EDNRBEDNRAARKIF11CYP2C9
SCHEMBL20848779 0.97 AR (0.33) EDNRBEDNRAARKIF11CYP2C9
SCHEMBL20848870 0.97 AR (0.33) EDNRBEDNRAARKIF11CYP2C9
SCHEMBL20848706 0.97 KIF11 (0.34) EDNRBEDNRAARKIF11CYP2C9
SCHEMBL20848707 0.97 KIF11 (0.34) EDNRBEDNRAARKIF11CYP2C9
SCHEMBL20848899 0.96 AR (0.34) EDNRBEDNRAARKIF11CYP2C9
SCHEMBL20848900 0.96 AR (0.34) EDNRBEDNRAARKIF11CYP2C9
SCHEMBL22985585 0.94 AR (0.35) ARKIF11PDPK1
SCHEMBL22985591 0.94 AR (0.35) ARKIF11PDPK1
SCHEMBL20848765 0.94 KIF11 (0.35) EDNRBEDNRAARKIF11CYP2C9

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

“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.