SCHEMBL20848870

SCHEMBL20848870

N#Cc1ccc(-n2c3ccc(-n4c5ccccc5c5ccccc54)cc3c3cc(-n4c5ccccc5c5ccccc54)ccc32)c(-c2ccc(-c3ccc(C(F)(F)F)cc3C(F)(F)F)cc2-n2c3ccc(-n4c5ccccc5c5ccccc54)cc3c3cc(-n4c5ccccc5c5ccccc54)ccc32)c1

nearest known ligand 0.35

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
AR P10275 4/20 0.33
KIF11 P52732 3/20 0.33
CYP2C9 P11712 1/20 0.33
SCN9A Q15858 1/20 0.33
ALOX5AP P20292 1/20 0.32
FEN1 P39748 1/20 0.32
PDPK1 O15530 1/20 0.32
EDNRB P24530 1/20 0.32
EDNRA P25101 1/20 0.32
ELANE P08246 6/20 0.32
PTGDR2 Q9Y5Y4 1/20 0.30
NR3C1 P04150 1/20 0.30
PGR P06401 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
SCHEMBL20848779 1.00 AR (0.33) ARKIF11CYP2C9SCN9AALOX5AP
SCHEMBL20848763 0.97 EDNRB (0.33) ARKIF11CYP2C9SCN9AALOX5AP
SCHEMBL20848768 0.97 EDNRB (0.33) ARKIF11CYP2C9SCN9AALOX5AP
SCHEMBL20848899 0.97 AR (0.34) ARKIF11CYP2C9SCN9AALOX5AP
SCHEMBL20848900 0.97 AR (0.34) ARKIF11CYP2C9SCN9AALOX5AP
SCHEMBL20848707 0.96 KIF11 (0.34) ARKIF11CYP2C9SCN9AALOX5AP
SCHEMBL20848706 0.96 KIF11 (0.34) ARKIF11CYP2C9SCN9AALOX5AP
SCHEMBL20848466 0.95 KIF11 (0.35) ARKIF11CYP2C9SCN9AALOX5AP
SCHEMBL20848776 0.95 KIF11 (0.35) ARKIF11CYP2C9SCN9AALOX5AP
SCHEMBL20849522 0.95 KIF11 (0.35) ARKIF11CYP2C9SCN9AALOX5AP

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 3706/4885KIF11 419/4885CYP2C9 725/4885
US-20190097141-A1 ORGANIC MOLECULES FOR USE IN OPTOELECTRONIC DEVICES OCIAD2, OCIAD1, POU2F1 AR 3706/4885KIF11 419/4885CYP2C9 725/4885

“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.