SCHEMBL21399458

SCHEMBL21399458

Cc1cccc(-c2ccc3c(c2)c2ccccc2n3-c2ccc(C#N)cc2-c2ccc(C(F)(F)F)cc2-n2c3ccccc3c3cc(-c4cccc(C)c4)ccc32)c1

nearest known ligand 0.39

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
AR P10275 1/20 0.39
PTGER4 P35408 1/20 0.36
ICMT O60725 1/20 0.35
PTPN5 P54829 1/20 0.35
KIF11 P52732 2/20 0.34
PDK2 Q15119 2/20 0.33
PTGDR2 Q9Y5Y4 2/20 0.33
MAT2A P31153 2/20 0.33
ELANE P08246 4/20 0.33
HCRTR1 O43613 1/20 0.32
HCRTR2 O43614 1/20 0.32
ENPP1 P22413 1/20 0.32
SERPINE1 P05121 1/20 0.32
GRIN1 Q05586 1/20 0.32
GRIN2B Q13224 1/20 0.32

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
SCHEMBL21399778 0.96 AR (0.39) ARPTGER4ICMTPTPN5KIF11
SCHEMBL21399575 0.96 AR (0.41) ARICMTPTPN5KIF11PDK2
SCHEMBL21399713 0.94 KIF11 (0.35) ARPTGER4PTPN5KIF11PDK2
SCHEMBL20849524 0.93 AR (0.39) ARPTGER4ICMTPTPN5KIF11
SCHEMBL22985344 0.93 AR (0.39) ARPTGER4ICMTPTPN5KIF11
SCHEMBL20849536 0.93 AR (0.38) ARPTGER4ICMTPTPN5PDK2
SCHEMBL21399576 0.93 KIF11 (0.37) ARPTGER4ICMTPTPN5KIF11
SCHEMBL21399299 0.92 AR (0.41) ARICMTPTPN5KIF11PDK2
SCHEMBL21399604 0.92 PTPN5 (0.42) PTGER4PTPN5KIF11PDK2PTGDR2
SCHEMBL21399267 0.91 KIF11 (0.39) PTGER4PTPN5KIF11PDK2PTGDR2

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-20190292151-A1 ORGANIC MOLECULES FOR USE IN OPTOELECTRONIC DEVICES SAMSUNG DISPLAY CO., LTD. (KR) 2019-09-26 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-20190292151-A1 ORGANIC MOLECULES FOR USE IN OPTOELECTRONIC DEVICES OR10J3, NR2E3, FOXO3 AR 1991/4885PTGER4 1117/4885ICMT 1483/4885

“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.