SCHEMBL20111864

SCHEMBL20111864

CC(C)(C)c1ccc2c3ccccc3n(-c3cc(-c4ccc(C(F)(F)F)cc4C(F)(F)F)cc(-n4c5ccccc5c5ccc(C(C)(C)C)cc54)c3C#N)c2c1

nearest known ligand 0.42

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
KIF11 P52732 2/20 0.42
PPARG P37231 1/20 0.33
PPARA Q07869 1/20 0.33
CYP2C9 P11712 1/20 0.32
SCN9A Q15858 1/20 0.32
MAT2A P31153 3/20 0.32
AR P10275 3/20 0.32
MEN1 O00255 1/20 0.31
KMT2A Q03164 1/20 0.31
ALDH1A1 P00352 1/20 0.31
MAPT P10636 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
TDP1 Q9NUW8 1/20 0.31
ALOX5AP P20292 1/20 0.30
FEN1 P39748 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
SCHEMBL20111862 0.95 KIF11 (0.38) KIF11PPARGPPARACYP2C9SCN9A
SCHEMBL20925147 0.95 KIF11 (0.43) KIF11CYP2C9SCN9AMAT2AAR
SCHEMBL26776994 0.92 KIF11 (0.36) KIF11ARMEN1KMT2A
SCHEMBL20616905 0.92 AR (0.39) KIF11SCN9AARMEN1KMT2A
SCHEMBL20111819 0.92 KIF11 (0.40) KIF11CYP2C9SCN9AARMEN1
SCHEMBL20111559 0.91 KIF11 (0.39) KIF11CYP2C9SCN9AARMEN1
SCHEMBL20925149 0.91 KIF11 (0.38) KIF11CYP2C9SCN9AARMEN1
SCHEMBL20111865 0.90 KIF11 (0.39) KIF11CYP2C9SCN9AMAT2AAR
SCHEMBL25660237 0.90 KIF11 (0.42) KIF11PPARGPPARASCN9AMAT2A
SCHEMBL21258795 0.90 KIF11 (0.38) KIF11PPARGPPARACYP2C9SCN9A

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-10971688-B2 Organic molecules for use in organic optoelectronic devices CYNORA GMBH (DE) 2021-04-06 US disclosed
US-20190248741-A1 ORGANIC MOLECULES FOR USE IN ORGANIC OPTOELECTRONIC DEVICES SAMSUNG DISPLAY CO., LTD. (KR) 2019-08-15 US disclosed
EP-3360945-B1 ORGANIC ELECTROLUMINESCENT DEVICE CYNORA GMBH (DE) 2019-04-24 EP disclosed
WO-2018077492-A1 ORGANIC MOLECULES, ESPECIALLY FOR USE IN ORGANIC OPTOELECTRONIC DEVICES CYNORA GMBH (DE) 2018-05-03 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-10971688-B2 Organic molecules for use in organic optoelectronic devices OR10J3, OR51E2, OPRM1 KIF11 3426/4885PPARG 3605/4885PPARA 3719/4885
US-20190248741-A1 ORGANIC MOLECULES FOR USE IN ORGANIC OPTOELECTRONIC DEVICES OR10J3, ORC3, AOC3 KIF11 3661/4885PPARG 4083/4885PPARA 4542/4885

“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.