SCHEMBL20848437

SCHEMBL20848437

Cc1cc(C)c(-c2ccc3c(c2)c2ccccc2n3-c2ccc(-c3ccc(C(F)(F)F)cc3C(F)(F)F)cc2-c2c(C#N)cccc2-n2c3ccccc3c3cc(-c4c(C)cc(C)cc4C)ccc32)c(C)c1

nearest known ligand 0.36

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
AR P10275 10/20 0.36
CYP2C9 P11712 1/20 0.33
SCN9A Q15858 1/20 0.33
EDNRB P24530 1/20 0.32
EDNRA P25101 1/20 0.32
PGR P06401 4/20 0.31
NR3C1 P04150 2/20 0.31
NR3C2 P08235 2/20 0.31
TSHR P16473 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
KIF11 P52732 1/20 0.30
BCAT1 P54687 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
SCHEMBL20849517 0.94 AR (0.37) ARCYP2C9SCN9AEDNRBEDNRA
SCHEMBL20848436 0.94 AR (0.36) ARCYP2C9SCN9AEDNRBEDNRA
SCHEMBL22985224 0.94 ALOX5AP (0.35) ARPGRNR3C1NR3C2TSHR
SCHEMBL20848739 0.93 AR (0.38) ARCYP2C9SCN9AEDNRBEDNRA
SCHEMBL20849165 0.93 AR (0.45) ARCYP2C9SCN9AEDNRBEDNRA
SCHEMBL20848737 0.93 AR (0.39) ARCYP2C9SCN9AEDNRBEDNRA
SCHEMBL20848806 0.93 AR (0.36) ARCYP2C9SCN9AEDNRBEDNRA
SCHEMBL21399570 0.93 KIF11 (0.34) ARPGRNR3C1NR3C2TSHR
SCHEMBL22985405 0.92 AR (0.36) ARPGRNR3C1NR3C2
SCHEMBL20849149 0.92 AR (0.42) ARCYP2C9SCN9AEDNRBEDNRA

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 3706/4885CYP2C9 725/4885SCN9A 1664/4885
US-20190097141-A1 ORGANIC MOLECULES FOR USE IN OPTOELECTRONIC DEVICES OCIAD2, OCIAD1, POU2F1 AR 3706/4885CYP2C9 725/4885SCN9A 1664/4885

“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.