SCHEMBL19903636

SCHEMBL19903636

CC(C)(C)c1ccc2c(c1)c1ccccc1n2-c1cc(C#N)cc(-n2c3ccccc3c3cc(C(C)(C)C)ccc32)c1-c1cc(C(F)(F)F)cc(C(F)(F)F)c1

nearest known ligand 0.37

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
KIF11 P52732 3/20 0.37
RORC P51449 5/20 0.34
RXRA P19793 1/20 0.34
RXRG P48443 1/20 0.34
PPARG P37231 2/20 0.33
PPARA Q07869 1/20 0.33
RAPGEF3 O95398 1/20 0.33
RAPGEF4 Q8WZA2 1/20 0.33
PGR P06401 2/20 0.32
TAS2R14 Q9NYV8 1/20 0.32
NR1H3 Q13133 1/20 0.32
AR P10275 2/20 0.32
RORA P35398 1/20 0.32
RORB Q92753 1/20 0.32
MAT2A P31153 1/20 0.32
TACR1 P25103 1/20 0.31
ICMT O60725 1/20 0.31

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
SCHEMBL22564465 0.98 KIF11 (0.37) KIF11RORCRXRARXRGPPARG
SCHEMBL19903639 0.95 KIF11 (0.41) KIF11RORCRXRARXRGPPARG
SCHEMBL19903687 0.94 KIF11 (0.39) KIF11RORCRXRARXRGPPARG
SCHEMBL19918009 0.94 KIF11 (0.37) KIF11RXRARXRGPPARGRAPGEF3
SCHEMBL19912463 0.94 KIF11 (0.34) KIF11RORCRXRARXRGPPARG
SCHEMBL22564464 0.93 KIF11 (0.41) KIF11RORCRXRARXRGPPARG
SCHEMBL22564387 0.92 KIF11 (0.39) KIF11RORCRXRARXRGPPARG
SCHEMBL22822245 0.92 RXRA (0.39) KIF11RXRARXRGPPARGRAPGEF3
SCHEMBL24002968 0.91 RXRA (0.39) KIF11RXRARXRGTAS2R14TACR1
SCHEMBL19903540 0.90 RXRA (0.36) KIF11RORCRXRARXRGTAS2R14

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10439151-B2 Organic molecules, especially for use in organic optoelectronic devices CYNORA GMBH (DE) 2019-10-08 US disclosed
US-20180062086-A1 ORGANIC MOLECULES, ESPECIALLY FOR USE IN ORGANIC OPTOELECTRONIC DEVICES SAMSUNG DISPLAY CO., LTD. (KR) 2018-03-01 US disclosed
EP-3287450-A1 ORGANIC MOLECULES, IN PARTICULAR FOR USE IN ORGANIC OPTOELECTRONIC DEVICES CYNORA GMBH (DE) 2018-02-28 EP 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-10439151-B2 Organic molecules, especially for use in organic optoelectronic devices OR10J3, ORC3, AOC3 KIF11 3253/4885RORC 2856/4885RXRA 3779/4885
US-20180062086-A1 ORGANIC MOLECULES, ESPECIALLY FOR USE IN ORGANIC OPTOELECTRONIC DEVICES OR10J3, ORC3, AOC3 KIF11 3316/4885RORC 2874/4885RXRA 3635/4885

“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.