SCHEMBL22985113

SCHEMBL22985113

Cc1nc(C)nc(-c2ccc3c(c2)c2ccccc2n3-c2ccc(C#N)cc2-c2cc(-c3ccc(C(F)(F)F)cc3C#N)ccc2-n2c3ccccc3c3cc(-c4nc(C)nc(C)n4)ccc32)n1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALOX5AP P20292 1/20 0.37
FEN1 P39748 1/20 0.37
PTGER4 P35408 3/20 0.37
XDH P47989 2/20 0.35
ELANE P08246 4/20 0.33
PSEN1 P49768 1/20 0.33
PSEN2 P49810 1/20 0.33
APH1B Q8WW43 1/20 0.33
NCSTN Q92542 1/20 0.33
APH1A Q96BI3 1/20 0.33
PSENEN Q9NZ42 1/20 0.33
KIF11 P52732 2/20 0.31
AR P10275 1/20 0.31
MAT2A P31153 1/20 0.31
DGAT1 O75907 1/20 0.31
SOAT1 P35610 1/20 0.31
KCNH2 Q12809 1/20 0.31
STS P08842 1/20 0.30
GRM5 P41594 2/20 0.30
TSHR P16473 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
SCHEMBL22985038 0.97 ALOX5AP (0.36) ALOX5APFEN1PTGER4XDHELANE
SCHEMBL22985198 0.97 ALOX5AP (0.36) ALOX5APFEN1PTGER4XDHELANE
SCHEMBL22985120 0.96 ALOX5AP (0.39) ALOX5APFEN1XDHELANEPSEN1
SCHEMBL22985740 0.93 ALOX5AP (0.37) ALOX5APFEN1PTGER4XDHELANE
SCHEMBL22985195 0.92 ALOX5AP (0.38) ALOX5APFEN1XDHELANEPSEN1
SCHEMBL22985489 0.92 ALOX5AP (0.38) ALOX5APFEN1XDHELANEPSEN1
SCHEMBL20848787 0.92 PTGER4 (0.37) ALOX5APFEN1PTGER4ELANEKIF11
SCHEMBL22985117 0.92 ALOX5AP (0.38) ALOX5APFEN1PTGER4XDHKIF11
SCHEMBL21399441 0.91 PTGER4 (0.39) PTGER4ELANEPSEN1PSEN2APH1B
SCHEMBL22985213 0.91 PTGER4 (0.34) ALOX5APFEN1PTGER4XDHELANE

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10919880-B2 Organic molecules, in particular for use in optoelectronic devices CYNORA GMBH (DE) 2021-02-16 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 (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-10919880-B2 Organic molecules, in particular for use in optoelectronic devices OCIAD1, OCIAD2, POU2F1 ALOX5AP 2567/4885FEN1 2939/4885PTGER4 3301/4885

“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.