SCHEMBL20849356

SCHEMBL20849356

N#Cc1ccc(-c2ccc3c(c2)c2cc(-c4ccc(C#N)cc4C#N)ccc2n3-c2ccc(-c3cc(C(F)(F)F)cc(C(F)(F)F)c3)c(-c3cc(C#N)ccc3-n3c4ccc(-c5ccc(C#N)cc5C#N)cc4c4cc(-c5ccc(C#N)cc5C#N)ccc43)c2)c(C#N)c1

nearest known ligand 0.33

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
ALOX5AP P20292 1/20 0.33
FEN1 P39748 1/20 0.33
KIF11 P52732 1/20 0.32
STS P08842 1/20 0.32
RXRA P19793 1/20 0.31
RXRG P48443 1/20 0.31
XDH P47989 1/20 0.30
KDM1A O60341 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
SCHEMBL20849317 0.95 STS (0.31) ALOX5APFEN1STSXDH
SCHEMBL20849374 0.94 NR3C1 (0.37) ALOX5APFEN1KIF11
SCHEMBL20849316 0.91 KIF11 (0.39) KIF11RXRARXRGKDM1A
SCHEMBL20849375 0.91 NR3C1 (0.35) ALOX5APFEN1
SCHEMBL20849422 0.91 KIF11 (0.34) KIF11RXRARXRG
SCHEMBL22985216 0.90 ALOX5AP (0.39) ALOX5APFEN1KIF11STSXDH
SCHEMBL20849396 0.89 RXRA (0.38) KIF11RXRARXRGXDH
SCHEMBL20849151 0.89 ALOX5AP (0.35) ALOX5APFEN1KIF11STSRXRA
SCHEMBL20849423 0.89 KIF11 (0.35) KIF11RXRARXRGKDM1A
SCHEMBL20848956 0.89 STS (0.37) ALOX5APFEN1KIF11STSRXRA

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 ALOX5AP 3630/4885FEN1 3586/4885KIF11 419/4885
US-20190097141-A1 ORGANIC MOLECULES FOR USE IN OPTOELECTRONIC DEVICES OCIAD2, OCIAD1, POU2F1 ALOX5AP 3630/4885FEN1 3586/4885KIF11 419/4885

“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.