SCHEMBL22985044

SCHEMBL22985044

N#Cc1ccc(-c2cccc(-n3c4ccccc4c4cc(-c5ccc(C(F)(F)F)cc5C(F)(F)F)ccc43)c2-c2c(C#N)cccc2-n2c3ccccc3c3cc(-c4ccc(C(F)(F)F)cc4C(F)(F)F)ccc32)c(C(F)(F)F)c1

nearest known ligand 0.37

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
AR P10275 8/20 0.37
PGR P06401 2/20 0.33
EDNRB P24530 1/20 0.33
EDNRA P25101 1/20 0.33
MAT2A P31153 1/20 0.31
PDE3B Q13370 1/20 0.31
PDE3A Q14432 1/20 0.31
ELANE P08246 2/20 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
KIF11 P52732 1/20 0.31
CYP2C9 P11712 1/20 0.30
SCN9A Q15858 1/20 0.30
ALOX5AP P20292 2/20 0.30
FEN1 P39748 2/20 0.30
CNR2 P34972 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
SCHEMBL22985043 0.97 AR (0.37) ARPGREDNRBEDNRAMAT2A
SCHEMBL20848878 0.96 AR (0.34) ARPGREDNRBEDNRAMAT2A
SCHEMBL20849216 0.96 AR (0.40) ARPGREDNRBEDNRAPDE3B
SCHEMBL20848859 0.94 KIF11 (0.32) ARMAT2AELANEGABRA1GABRG2
SCHEMBL22985734 0.94 ELANE (0.33) ARMAT2AELANEKIF11SCN9A
SCHEMBL22985102 0.93 AR (0.37) ARPGRPDE3BPDE3AGABRA1
SCHEMBL20848502 0.93 AR (0.37) ARPGREDNRBEDNRAPDE3B
SCHEMBL22985447 0.92 AR (0.39) ARPGREDNRBEDNRAPDE3B
SCHEMBL22985147 0.92 AR (0.36) ARPGRPDE3BPDE3AGABRA1
SCHEMBL20848818 0.92 ALOX5AP (0.35) ARPGREDNRBEDNRAMAT2A

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10919880-B2 Organic molecules, in particular for use in optoelectronic devices CYNORA GMBH (DE) 2021-02-16 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 (1 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-10919880-B2 Organic molecules, in particular for use in optoelectronic devices OCIAD1, OCIAD2, POU2F1 AR 3541/4885PGR 3779/4885EDNRB 1897/4885

“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.