SCHEMBL19903661

SCHEMBL19903661

N#Cc1cc(C#N)cc(-c2ccc3c4ccccc4n(-c4cc(-c5cc(C(F)(F)F)cc(C(F)(F)F)c5)cc(-n5c6ccccc6c6ccc(-c7cc(C#N)cc(C#N)c7)cc65)c4C#N)c3c2)c1

nearest known ligand 0.41

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
RXRA P19793 1/20 0.41
RXRG P48443 1/20 0.41
KIF11 P52732 2/20 0.34
PGR P06401 2/20 0.34
XDH P47989 1/20 0.33
PTPN5 P54829 1/20 0.33
TAS2R14 Q9NYV8 1/20 0.32
PDPK1 O15530 1/20 0.32
GRIN1 Q05586 2/20 0.32
GRIN2B Q13224 2/20 0.32
TACR1 P25103 2/20 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
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
SCHEMBL21414233 1.00 RXRA (0.41) RXRARXRGKIF11PGRXDH
SCHEMBL20617436 0.99 RXRA (0.41) RXRARXRGKIF11PGRXDH
SCHEMBL20617387 0.99 RXRA (0.41) RXRARXRGKIF11PGRXDH
SCHEMBL22822504 0.95 RXRA (0.45) RXRARXRGKIF11PGRXDH
SCHEMBL20617385 0.95 RXRA (0.42) RXRARXRGKIF11PGRXDH
SCHEMBL19917998 0.94 RXRA (0.44) RXRARXRGKIF11PGRXDH
SCHEMBL19918048 0.94 KIF11 (0.38) RXRARXRGKIF11PDPK1TACR1
SCHEMBL22822641 0.94 PTPN5 (0.41) RXRARXRGKIF11PGRPTPN5
SCHEMBL21546825 0.94 PTPN5 (0.41) RXRARXRGKIF11PGRPTPN5
SCHEMBL19918029 0.94 PTPN5 (0.41) RXRARXRGKIF11PGRPTPN5

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.