SCHEMBL20623729

SCHEMBL20623729

CC(C)(C)c1ccc2c(c1)c1ccccc1n2-c1cc(C#N)c(-c2c(C(F)(F)F)cccc2C(F)(F)F)cc1-n1c2ccccc2c2cc(C(C)(C)C)ccc21

nearest known ligand 0.38

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
AR P10275 13/20 0.38
RORC P51449 1/20 0.37
TRPA1 O75762 1/20 0.36
KIF11 P52732 1/20 0.33
PTGES O14684 1/20 0.33
PPARG P37231 1/20 0.32
PPARA Q07869 1/20 0.32
SLC22A12 Q96S37 2/20 0.32

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
SCHEMBL20611569 0.96 AR (0.37) ARRORCTRPA1KIF11PTGES
SCHEMBL21898522 0.96 AR (0.36) ARTRPA1SLC22A12
SCHEMBL20623728 0.95 KIF11 (0.38) ARRORCTRPA1KIF11PPARG
SCHEMBL21898735 0.94 TRPA1 (0.37) ARRORCTRPA1KIF11PTGES
SCHEMBL20611573 0.91 KIF11 (0.36) ARRORCTRPA1KIF11PTGES
SCHEMBL21898841 0.90 TRPA1 (0.35) ARTRPA1KIF11
SCHEMBL21898695 0.90 AR (0.36) ARRORCPPARGPPARA
SCHEMBL20611915 0.90 TRPA1 (0.36) ARRORCTRPA1KIF11
SCHEMBL21898737 0.89 AR (0.37) ARTRPA1
SCHEMBL21898693 0.89 KIF11 (0.38) ARRORCTRPA1KIF11PPARG

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11661412-B2 Organic molecules for use in organic optoelectronic devices SAMSUNG DISPLAY CO., LTD. (KR) 2023-05-30 US disclosed
EP-3645523-B1 ORGANIC MOLECULES, ESPECIALLY FOR USE IN OPTOELECTRONIC DEVICES SAMSUNG DISPLAY CO LTD (KR) 2022-08-03 EP disclosed
US-20200123131-A1 ORGANIC MOLECULES FOR USE IN ORGANIC OPTOELECTRONIC DEVICES SAMSUNG DISPLAY CO., LTD. (KR) 2020-04-23 US disclosed
WO-2019002175-A1 ORGANIC MOLECULES, ESPECIALLY FOR USE IN OPTOELECTRONIC DEVICES CYNORA GMBH (DE) 2019-01-03 WO 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-20200123131-A1 ORGANIC MOLECULES FOR USE IN ORGANIC OPTOELECTRONIC DEVICES OR10J3, AOC3, MT-CO3 AR 4468/4885RORC 2887/4885TRPA1 899/4885
US-11661412-B2 Organic molecules for use in organic optoelectronic devices OR10J3, OR51E2, AOX1 AR 4596/4885RORC 1876/4885TRPA1 38/4885

“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.