SCHEMBL19903528

SCHEMBL19903528

N#Cc1cc(-n2c3ccccc3c3cc(-c4cc(C(F)(F)F)cc(C(F)(F)F)c4)ccc32)c(-c2cc(C(F)(F)F)cc(C(F)(F)F)c2)c(-n2c3ccccc3c3cc(-c4cc(C(F)(F)F)cc(C(F)(F)F)c4)ccc32)c1

nearest known ligand 0.40

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
RXRA P19793 1/20 0.40
RXRG P48443 1/20 0.40
ICMT O60725 6/20 0.35
KIF11 P52732 2/20 0.35
TACR1 P25103 4/20 0.33
TAS2R14 Q9NYV8 1/20 0.33
XDH P47989 1/20 0.32
PTPN5 P54829 1/20 0.32
PTGER4 P35408 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
SCHEMBL20617427 0.99 RXRA (0.41) RXRARXRGICMTKIF11TACR1
SCHEMBL21414125 0.98 RXRA (0.41) RXRARXRGICMTKIF11TACR1
SCHEMBL19903472 0.98 RXRA (0.41) RXRARXRGICMTKIF11TACR1
SCHEMBL20617417 0.97 RXRA (0.41) RXRARXRGICMTKIF11TACR1
SCHEMBL19917974 0.96 KIF11 (0.42) RXRARXRGKIF11TACR1PTPN5
SCHEMBL19903668 0.96 RXRA (0.41) RXRARXRGICMTKIF11TACR1
SCHEMBL19903675 0.94 RXRA (0.43) RXRARXRGICMTKIF11TAS2R14
SCHEMBL19917947 0.94 RXRA (0.36) RXRARXRGICMTKIF11TACR1
SCHEMBL21546622 0.94 PTPN5 (0.41) RXRARXRGICMTTACR1PTPN5
SCHEMBL19903439 0.94 PTPN5 (0.41) RXRARXRGKIF11TACR1PTPN5

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 3669/4885ICMT 156/4885
US-20180062086-A1 ORGANIC MOLECULES, ESPECIALLY FOR USE IN ORGANIC OPTOELECTRONIC DEVICES OR10J3, ORC3, AOC3 RXRA 3635/4885RXRG 3474/4885ICMT 127/4885

“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.