SCHEMBL22985170

SCHEMBL22985170

N#Cc1cccc(-c2ccc3c(c2)c2ccccc2n3-c2ccc(-c3ccc(C(F)(F)F)cc3C#N)c(-c3cc(C#N)ccc3-n3c4ccccc4c4cc(-c5cccc(C#N)c5)ccc43)c2)c1

nearest known ligand 0.36

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
PTPN5 P54829 1/20 0.36
PDK2 Q15119 1/20 0.35
MAT2A P31153 1/20 0.33
PTGDR2 Q9Y5Y4 1/20 0.33
CETP P11597 1/20 0.32
ALOX5AP P20292 1/20 0.32
FEN1 P39748 1/20 0.32
GRIN1 Q05586 2/20 0.31
GRIN2B Q13224 2/20 0.31
KIF11 P52732 1/20 0.31
SGK1 O00141 1/20 0.31
TRPA1 O75762 1/20 0.30
ENPP1 P22413 1/20 0.30
PRF1 P14222 1/20 0.30
CHEK1 O14757 1/20 0.30
PDPK1 O15530 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
SCHEMBL22985135 0.97 PTPN5 (0.36) PTPN5PDK2MAT2APTGDR2CETP
SCHEMBL22985063 0.96 KIF11 (0.33) PTPN5PDK2PTGDR2ALOX5APFEN1
SCHEMBL22985699 0.95 ALOX5AP (0.32) PTPN5ALOX5APFEN1KIF11PDPK1
SCHEMBL22985168 0.95 KIF11 (0.36) PTPN5PDK2PTGDR2ALOX5APFEN1
SCHEMBL22985620 0.94 AR (0.38) PTPN5ALOX5APFEN1KIF11
SCHEMBL22985169 0.93 ALOX5AP (0.32) ALOX5APFEN1KIF11PDPK1
SCHEMBL22985211 0.93 ALOX5AP (0.36) ALOX5APFEN1KIF11PDPK1
SCHEMBL22985474 0.93 KIF11 (0.35) PTPN5PDK2PTGDR2ALOX5APFEN1
SCHEMBL24370109 0.93 PTPN5 (0.34) PTPN5PDK2MAT2APTGDR2ALOX5AP
SCHEMBL22985468 0.92 KIF11 (0.33) ALOX5APFEN1KIF11

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 PTPN5 4289/4885PDK2 764/4885MAT2A 2649/4885

“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.