SCHEMBL21116495

SCHEMBL21116495

Cc1cccc(-c2ccc3c(c2)c2ccccc2n3-c2cc(-c3ccc(C(F)(F)F)c(-n4c5ccccc5c5cc(-c6cccc(C)c6)ccc54)c3)ccc2C(F)(F)F)c1

nearest known ligand 0.44

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
AR P10275 1/20 0.44
ENPP1 P22413 1/20 0.38
ICMT O60725 3/20 0.37
PTPN5 P54829 1/20 0.36
PDK2 Q15119 1/20 0.36
NR3C1 P04150 1/20 0.34
SERPINE1 P05121 1/20 0.34
TSPO P30536 1/20 0.34
RORC P51449 1/20 0.34
ALDH1A1 P00352 2/20 0.33
MAP4K4 O95819 1/20 0.33
KIF11 P52732 1/20 0.33
HSD11B1 P28845 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
TSHR P16473 1/20 0.33
MAPK1 P28482 1/20 0.33
RXFP1 Q9HBX9 1/20 0.33

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
SCHEMBL21116496 0.95 AR (0.48) ARENPP1ICMTPTPN5PDK2
SCHEMBL21116497 0.93 AR (0.44) ARENPP1ICMTPTPN5PDK2
SCHEMBL21116558 0.91 BCHE (0.36) ARRORCALDH1A1KIF11HSD11B1
SCHEMBL21116517 0.91 BCHE (0.36) ARRORCALDH1A1KIF11HSD11B1
SCHEMBL21116344 0.88 TSPO (0.40) TSPORORCALDH1A1KIF11L3MBTL1
SCHEMBL21116498 0.87 AR (0.48) ARENPP1ICMTPTPN5PDK2
SCHEMBL21132064 0.87 AR (0.41) ARENPP1ICMTPTPN5PDK2
SCHEMBL21116560 0.86 TRPA1 (0.36) ARENPP1NR3C1RORCALDH1A1
SCHEMBL21116516 0.86 KIF11 (0.38) ARRORCALDH1A1KIF11HSD11B1
SCHEMBL21116348 0.84 KIF11 (0.39) TSPOALDH1A1KIF11L3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11136294-B2 Organic molecules for use in optoelectronic devices CYNORA GMBH (DE) 2021-10-05 US disclosed
EP-3478656-B1 DICARBAZOLE DIPHENYL DERIVATIVES FOR USE IN OPTOPELECTRONIC DEVICES CYNORA GMBH (DE) 2021-09-08 EP disclosed
US-20190194130-A1 ORGANIC MOLECULES FOR USE IN OPTOELECTRONIC DEVICES CYNORA GMBH (DE) 2019-06-27 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-20190194130-A1 ORGANIC MOLECULES FOR USE IN OPTOELECTRONIC DEVICES OR10J3, NOX3, ORC3 AR 1096/4885ENPP1 4686/4885ICMT 2503/4885
US-11136294-B2 Organic molecules for use in optoelectronic devices OR10J3, ORC3, NOX3 AR 1080/4885ENPP1 4686/4885ICMT 2637/4885

“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.