SCHEMBL22985154

SCHEMBL22985154

N#Cc1ccc(-n2c3ccc(-c4nc(-c5ccccc5)nc(-c5ccccc5)n4)cc3c3cc(-c4nc(-c5ccccc5)nc(-c5ccccc5)n4)ccc32)c(-c2cc(-n3c4ccc(-c5nc(-c6ccccc6)nc(-c6ccccc6)n5)cc4c4cc(-c5nc(-c6ccccc6)nc(-c6ccccc6)n5)ccc43)ccc2-c2ccc(C(F)(F)F)cc2C#N)c1

nearest known ligand 0.33

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALOX5AP P20292 1/20 0.33
FEN1 P39748 1/20 0.33
XDH P47989 2/20 0.32
PDPK1 O15530 1/20 0.31
MAT2A P31153 1/20 0.31
ALDH1A1 P00352 2/20 0.31
LMNA P02545 2/20 0.31
DGAT1 O75907 1/20 0.31
SOAT1 P35610 1/20 0.31
KCNH2 Q12809 1/20 0.31
MEN1 O00255 1/20 0.31
CYP1A2 P05177 1/20 0.31
CYP3A4 P08684 1/20 0.31
CYP2D6 P10635 1/20 0.31
CYP2C9 P11712 1/20 0.31
TSHR P16473 1/20 0.31
CYP2C19 P33261 1/20 0.31
KMT2A Q03164 1/20 0.31
HSD17B10 Q99714 1/20 0.31
CLK4 Q9HAZ1 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
SCHEMBL22985644 0.98 ALOX5AP (0.32) ALOX5APFEN1XDHPDPK1ALDH1A1
SCHEMBL22985474 0.92 KIF11 (0.35) ALOX5APFEN1XDHALDH1A1DGAT1
SCHEMBL20910475 0.91 XDH (0.35) ALOX5APFEN1XDHPDPK1MAT2A
SCHEMBL22985040 0.91 ALOX5AP (0.38) ALOX5APFEN1XDHMAT2AALDH1A1
SCHEMBL22985118 0.91 ALOX5AP (0.39) ALOX5APFEN1XDHMAT2AALDH1A1
SCHEMBL22985215 0.90 ALOX5AP (0.33) ALOX5APFEN1XDHDGAT1SOAT1
SCHEMBL22985063 0.90 KIF11 (0.33) ALOX5APFEN1PDPK1KIF11
SCHEMBL22985213 0.90 PTGER4 (0.34) ALOX5APFEN1XDHPDPK1ELANE
SCHEMBL22243046 0.90 ABCG2 (0.34) PDPK1MAT2AALDH1A1LMNADGAT1
SCHEMBL20849228 0.90 PDPK1 (0.32) PDPK1ALDH1A1LMNAMEN1CYP1A2

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 2939/4885XDH 1167/4885

“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.