SCHEMBL20849376

SCHEMBL20849376

N#Cc1cccc(-c2ccc3c(c2)c2ccccc2n3-c2ccc(-c3cc(C(F)(F)F)cc(C(F)(F)F)c3)c(-c3cc(C#N)ccc3-n3c4ccccc4c4cc(-c5cccc(C#N)c5)ccc43)c2)c1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDK2 Q15119 1/20 0.36
PTPN5 P54829 1/20 0.36
CETP P11597 1/20 0.33
GRIN1 Q05586 2/20 0.33
GRIN2B Q13224 2/20 0.33
MAT2A P31153 1/20 0.33
ENPP1 P22413 1/20 0.32
PRF1 P14222 1/20 0.32
CHEK1 O14757 1/20 0.31
SSTR2 P30874 1/20 0.31
PDPK1 O15530 1/20 0.31
RXRA P19793 1/20 0.31
RXRG P48443 1/20 0.31
PTGDR2 Q9Y5Y4 1/20 0.31
PTGER4 P35408 1/20 0.30
SGK1 O00141 1/20 0.30
MEN1 O00255 1/20 0.30
KMT2A Q03164 1/20 0.30
KIF11 P52732 1/20 0.30
MAP4K4 O95819 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
SCHEMBL20849390 0.96 PDK2 (0.36) PDK2PTPN5CETPGRIN1GRIN2B
SCHEMBL20849412 0.95 RXRA (0.33) PDK2PTPN5PDPK1RXRARXRG
SCHEMBL20849034 0.95 PDPK1 (0.32) PDK2PDPK1RXRARXRGPTGER4
SCHEMBL20849399 0.95 RXRA (0.35) PDK2PTPN5PDPK1RXRARXRG
SCHEMBL20849315 0.95 KIF11 (0.36) PDK2PTPN5PDPK1RXRARXRG
SCHEMBL20849324 0.93 AR (0.35) PDK2PTPN5PTGER4
SCHEMBL20849411 0.93 RXRA (0.35) PDK2PTPN5PDPK1RXRARXRG
SCHEMBL20848831 0.93 PDPK1 (0.32) PDK2PDPK1KIF11
SCHEMBL20849419 0.93 PDPK1 (0.32) PDK2PDPK1KIF11
SCHEMBL20849420 0.91 KIF11 (0.33) CETPPDPK1KIF11

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 PDK2 1574/4885PTPN5 4494/4885CETP 905/4885
US-20190097141-A1 ORGANIC MOLECULES FOR USE IN OPTOELECTRONIC DEVICES OCIAD2, OCIAD1, POU2F1 PDK2 1574/4885PTPN5 4494/4885CETP 905/4885

“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.