SCHEMBL20848561

SCHEMBL20848561

N#Cc1ccc(-n2c3ccccc3c3cc(C#N)ccc32)c(-c2cc(-c3c(C(F)(F)F)cccc3C(F)(F)F)ccc2-n2c3ccccc3c3cc(C#N)ccc32)c1

nearest known ligand 0.36

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
AR P10275 6/20 0.36
ACP1 P24666 1/20 0.36
KIF11 P52732 1/20 0.35
SLC22A12 Q96S37 4/20 0.34
PTGER4 P35408 1/20 0.33
RORC P51449 1/20 0.33
PDPK1 O15530 1/20 0.32
PGR P06401 1/20 0.32
PDK2 Q15119 1/20 0.32
TRPV4 Q9HBA0 1/20 0.32
XDH P47989 1/20 0.31
USP1 O94782 1/20 0.31
WDR48 Q8TAF3 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
SCHEMBL20848555 0.95 KIF11 (0.38) ARACP1KIF11SLC22A12PGR
SCHEMBL20849043 0.95 AR (0.34) ARACP1KIF11SLC22A12PTGER4
SCHEMBL20849261 0.95 KIF11 (0.41) ARACP1KIF11SLC22A12PTGER4
SCHEMBL20849372 0.95 AR (0.34) ARACP1KIF11SLC22A12PTGER4
SCHEMBL20848559 0.94 PDPK1 (0.34) ARACP1KIF11SLC22A12PTGER4
SCHEMBL20849640 0.94 PDPK1 (0.34) ARACP1KIF11SLC22A12PTGER4
SCHEMBL20848601 0.94 PDK2 (0.38) ARACP1KIF11SLC22A12PTGER4
SCHEMBL20849639 0.94 KIF11 (0.38) ARACP1KIF11SLC22A12PTGER4
SCHEMBL20848562 0.94 KIF11 (0.36) ARACP1KIF11SLC22A12RORC
SCHEMBL20848995 0.93 AR (0.37) ARACP1KIF11SLC22A12PTGER4

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 AR 3706/4885ACP1 2186/4885KIF11 419/4885
US-20190097141-A1 ORGANIC MOLECULES FOR USE IN OPTOELECTRONIC DEVICES OCIAD2, OCIAD1, POU2F1 AR 3706/4885ACP1 2186/4885KIF11 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.