SCHEMBL20849152

SCHEMBL20849152

N#Cc1cc(C#N)cc(-c2ccc3c(c2)c2ccccc2n3-c2ccc(C#N)cc2-c2ccc(-c3cc(C(F)(F)F)cc(C(F)(F)F)c3)cc2-n2c3ccccc3c3cc(-c4cc(C#N)cc(C#N)c4)ccc32)c1

nearest known ligand 0.38

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
RXRA P19793 1/20 0.38
RXRG P48443 1/20 0.38
ICMT O60725 2/20 0.33
PDK2 Q15119 2/20 0.33
KIF11 P52732 1/20 0.33
TACR1 P25103 2/20 0.33
PTPN5 P54829 1/20 0.32
PTGER4 P35408 1/20 0.32
PGR P06401 1/20 0.32
CETP P11597 1/20 0.30
XDH P47989 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
SCHEMBL20849579 0.97 RXRA (0.35) RXRARXRGICMTPDK2KIF11
SCHEMBL20849319 0.96 RXRA (0.38) RXRARXRGICMTPDK2KIF11
SCHEMBL20848919 0.96 RXRA (0.39) RXRARXRGICMTPDK2KIF11
SCHEMBL20849583 0.95 PDK2 (0.39) RXRARXRGICMTPDK2KIF11
SCHEMBL20848855 0.95 KIF11 (0.39) RXRARXRGICMTPDK2KIF11
SCHEMBL20848771 0.95 RXRA (0.35) RXRARXRGICMTPDK2KIF11
SCHEMBL20848955 0.95 RXRA (0.39) RXRARXRGICMTPDK2KIF11
SCHEMBL20849508 0.95 RXRA (0.41) RXRARXRGICMTPDK2KIF11
SCHEMBL20848764 0.94 RXRA (0.38) RXRARXRGICMTPDK2KIF11
SCHEMBL20849572 0.93 RXRA (0.35) RXRARXRGICMTPDK2KIF11

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10978646-B2 Organic molecules for use in optoelectronic devices CYNORA GMBH (DE) 2021-04-13 US disclosed
US-20190097141-A1 ORGANIC MOLECULES FOR USE IN OPTOELECTRONIC DEVICES SAMSUNG DISPLAY CO., LTD. (KR) 2019-03-28 US 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-10978646-B2 Organic molecules for use in optoelectronic devices OCIAD2, OCIAD1, POU2F1 RXRA 1822/4885RXRG 1841/4885ICMT 616/4885
US-20190097141-A1 ORGANIC MOLECULES FOR USE IN OPTOELECTRONIC DEVICES OCIAD2, OCIAD1, POU2F1 RXRA 1822/4885RXRG 1841/4885ICMT 616/4885

“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.