SCHEMBL25660930

SCHEMBL25660930

N#Cc1ccc(-c2ccc3c(c2)c2ccccc2n3-c2cc(C#N)c(-c3ccc(C(F)(F)F)cc3C#N)cc2-n2c3ccccc3c3cc(-c4ccc(C#N)cc4)ccc32)cc1

nearest known ligand 0.41

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
KIF11 P52732 5/20 0.41
DGAT1 O75907 1/20 0.38
SOAT1 P35610 1/20 0.38
KCNH2 Q12809 1/20 0.38
PDK2 Q15119 1/20 0.36
ALOX5AP P20292 1/20 0.36
FEN1 P39748 1/20 0.36
PTGER4 P35408 1/20 0.34
PTPN5 P54829 2/20 0.34
PTGDR2 Q9Y5Y4 1/20 0.34
PDPK1 O15530 1/20 0.34
KDM1A O60341 2/20 0.33
PGR P06401 1/20 0.31
XDH P47989 1/20 0.31
AR P10275 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
SCHEMBL25660948 0.95 KIF11 (0.46) KIF11DGAT1SOAT1KCNH2PDK2
SCHEMBL25660929 0.94 KIF11 (0.41) KIF11DGAT1SOAT1KCNH2PDK2
SCHEMBL21258620 0.93 KIF11 (0.39) KIF11DGAT1SOAT1KCNH2PDK2
SCHEMBL25660933 0.92 PTPN5 (0.40) KIF11PDK2ALOX5APFEN1PTPN5
SCHEMBL26777703 0.92 KIF11 (0.37) KIF11DGAT1SOAT1KCNH2PDK2
SCHEMBL25659736 0.92 KIF11 (0.45) KIF11DGAT1SOAT1KCNH2PDK2
SCHEMBL25660876 0.91 ALOX5AP (0.37) KIF11ALOX5APFEN1XDHAR
SCHEMBL25660834 0.91 ALOX5AP (0.39) KIF11DGAT1KCNH2ALOX5APFEN1
SCHEMBL25659642 0.90 ALOX5AP (0.37) KIF11DGAT1KCNH2ALOX5APFEN1
SCHEMBL25659753 0.89 ALOX5AP (0.36) KIF11DGAT1SOAT1KCNH2PDK2

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-11825743-B2 Organic molecules for use in organic optoelectronic devices SAMSUNG DISPLAY CO., LTD. (KR) 2023-11-21 US disclosed
EP-3585777-B1 ORGANIC MOLECULES, ESPECIALLY FOR USE IN ORGANIC OPTOELECTRONIC DEVICES SAMSUNG DISPLAY CO LTD (KR) 2023-05-10 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 (1 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-11825743-B2 Organic molecules for use in organic optoelectronic devices OR10J3, OR51E2, OCIAD2 KIF11 3288/4885DGAT1 512/4885SOAT1 134/4885

“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.