SCHEMBL20623728

SCHEMBL20623728

CC(C)(C)c1ccc2c3ccccc3n(-c3cc(C#N)c(-c4c(C(F)(F)F)cccc4C(F)(F)F)cc3-n3c4ccccc4c4ccc(C(C)(C)C)cc43)c2c1

nearest known ligand 0.38

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
KIF11 P52732 1/20 0.38
AR P10275 15/20 0.36
TRPA1 O75762 1/20 0.35
RORC P51449 1/20 0.33
PPARG P37231 1/20 0.32
PPARA Q07869 1/20 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
SCHEMBL20611573 0.96 KIF11 (0.36) KIF11ARTRPA1RORCPPARG
SCHEMBL21898841 0.96 TRPA1 (0.35) KIF11ARTRPA1
SCHEMBL20623729 0.95 AR (0.38) KIF11ARTRPA1RORCPPARG
SCHEMBL21898693 0.94 KIF11 (0.38) KIF11ARTRPA1RORCPPARG
SCHEMBL21898487 0.93 KIF11 (0.42) KIF11ARTRPA1
SCHEMBL20611569 0.91 AR (0.37) KIF11ARTRPA1RORC
SCHEMBL20617177 0.91 TRPA1 (0.45) KIF11ARTRPA1RORC
SCHEMBL21898522 0.91 AR (0.36) ARTRPA1
SCHEMBL21898735 0.89 TRPA1 (0.37) KIF11ARTRPA1RORC
SCHEMBL21898739 0.88 TRPA1 (0.37) KIF11ARTRPA1

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 KIF11 3795/4885AR 4468/4885TRPA1 899/4885
US-11661412-B2 Organic molecules for use in organic optoelectronic devices OR10J3, OR51E2, AOX1 KIF11 3254/4885AR 4596/4885TRPA1 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.