SCHEMBL20848469

SCHEMBL20848469

N#Cc1ccc(-c2ccc3c(c2)c2ccccc2n3-c2ccc(C#N)cc2-c2ccc(-c3c(C(F)(F)F)cccc3C(F)(F)F)cc2-n2c3ccccc3c3cc(-c4ccc(C#N)cc4)ccc32)cc1

nearest known ligand 0.39

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
KIF11 P52732 2/20 0.39
PDK2 Q15119 2/20 0.36
PTGER4 P35408 1/20 0.34
ACP1 P24666 1/20 0.33
AR P10275 3/20 0.33
PTPN5 P54829 1/20 0.32
RORC P51449 2/20 0.32
PDPK1 O15530 1/20 0.32
SLC22A12 Q96S37 2/20 0.31
PRF1 P14222 1/20 0.31
USP1 O94782 1/20 0.31
WDR48 Q8TAF3 1/20 0.31
SYK P43405 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
SCHEMBL20849194 0.97 KIF11 (0.36) KIF11PDK2PTGER4ACP1AR
SCHEMBL20849172 0.96 KIF11 (0.39) KIF11PDK2PTGER4ACP1AR
SCHEMBL20849623 0.96 KIF11 (0.40) KIF11PDK2PTGER4ACP1AR
SCHEMBL20849126 0.96 KIF11 (0.41) KIF11PDK2ACP1ARPTPN5
SCHEMBL20849633 0.95 PDK2 (0.39) KIF11PDK2PTGER4ACP1AR
SCHEMBL20849372 0.95 AR (0.34) KIF11PDK2PTGER4ACP1AR
SCHEMBL20849261 0.95 KIF11 (0.41) KIF11PDK2PTGER4ACP1AR
SCHEMBL20849131 0.94 PDK2 (0.34) KIF11PDK2PTGER4ACP1AR
SCHEMBL20849370 0.94 KIF11 (0.38) KIF11PDK2ACP1ARPTPN5
SCHEMBL20848546 0.93 KIF11 (0.36) KIF11PDK2PTGER4ACP1AR

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 KIF11 419/4885PDK2 1574/4885PTGER4 3716/4885
US-20190097141-A1 ORGANIC MOLECULES FOR USE IN OPTOELECTRONIC DEVICES OCIAD2, OCIAD1, POU2F1 KIF11 419/4885PDK2 1574/4885PTGER4 3716/4885

“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.