SCHEMBL19903516

SCHEMBL19903516

N#Cc1cc(C#N)cc(-c2ccc3c(c2)c2cc(-c4cc(C#N)cc(C#N)c4)ccc2n3-c2cc(C#N)cc(-n3c4ccc(-c5cc(C#N)cc(C#N)c5)cc4c4cc(-c5cc(C#N)cc(C#N)c5)ccc43)c2-c2cc(C(F)(F)F)cc(C(F)(F)F)c2)c1

nearest known ligand 0.44

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
RXRA P19793 2/20 0.44
RXRG P48443 2/20 0.44
KIF11 P52732 2/20 0.37
XDH P47989 1/20 0.36
ICMT O60725 7/20 0.33
NAAA Q02083 1/20 0.33
APP P05067 1/20 0.33
BACE1 P56817 1/20 0.33
P2RY14 Q15391 1/20 0.32
MAT2A P31153 1/20 0.32
MAP4K4 O95819 1/20 0.32
CYP11B1 P15538 1/20 0.32
CYP11B2 P19099 1/20 0.32
RXRB P28702 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
SCHEMBL21414193 1.00 RXRA (0.44) RXRARXRGKIF11XDHICMT
SCHEMBL20616995 0.99 RXRA (0.45) RXRARXRGKIF11XDHICMT
SCHEMBL20617431 0.99 RXRA (0.45) RXRARXRGKIF11XDHICMT
SCHEMBL19903675 0.97 RXRA (0.43) RXRARXRGKIF11XDHICMT
SCHEMBL21414125 0.94 RXRA (0.41) RXRARXRGKIF11XDHICMT
SCHEMBL19903472 0.94 RXRA (0.41) RXRARXRGKIF11XDHICMT
SCHEMBL20617417 0.93 RXRA (0.41) RXRARXRGKIF11XDHICMT
SCHEMBL20617427 0.93 RXRA (0.41) RXRARXRGKIF11XDHICMT
SCHEMBL20617411 0.93 KIF11 (0.47) RXRARXRGKIF11XDHMAP4K4
SCHEMBL19903563 0.93 KIF11 (0.47) RXRARXRGKIF11XDHNAAA

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 5 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
EP-3360945-B1 ORGANIC ELECTROLUMINESCENT DEVICE CYNORA GMBH (DE) 2019-04-24 EP disclosed
EP-3287450-B1 ORGANIC MOLECULES, IN PARTICULAR FOR USE IN ORGANIC OPTOELECTRONIC DEVICES CYNORA GMBH (DE) 2019-03-20 EP 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 RXRA 3779/4885RXRG 3669/4885KIF11 3253/4885
US-20180062086-A1 ORGANIC MOLECULES, ESPECIALLY FOR USE IN ORGANIC OPTOELECTRONIC DEVICES OR10J3, ORC3, AOC3 RXRA 3635/4885RXRG 3474/4885KIF11 3316/4885

“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.